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Details

Stereochemistry ACHIRAL
Molecular Formula C16H13NO3
Molecular Weight 267.2793
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 5-(PHENYLMETHOXY)-1H-INDOLE-2-CARBOXYLIC ACID

SMILES

OC(=O)C1=CC2=C(N1)C=CC(OCC3=CC=CC=C3)=C2

InChI

InChIKey=MVCLSAMNMAWXFQ-UHFFFAOYSA-N
InChI=1S/C16H13NO3/c18-16(19)15-9-12-8-13(6-7-14(12)17-15)20-10-11-4-2-1-3-5-11/h1-9,17H,10H2,(H,18,19)

HIDE SMILES / InChI

Molecular Formula C16H13NO3
Molecular Weight 267.2793
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 12:25:15 GMT 2023
Edited
by admin
on Sat Dec 16 12:25:15 GMT 2023
Record UNII
QC9YQ3S9RU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
5-(PHENYLMETHOXY)-1H-INDOLE-2-CARBOXYLIC ACID
Systematic Name English
NSC-49096
Code English
NSC-30930
Code English
Code System Code Type Description
NSC
49096
Created by admin on Sat Dec 16 12:25:15 GMT 2023 , Edited by admin on Sat Dec 16 12:25:15 GMT 2023
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NSC
30930
Created by admin on Sat Dec 16 12:25:15 GMT 2023 , Edited by admin on Sat Dec 16 12:25:15 GMT 2023
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EPA CompTox
DTXSID20216621
Created by admin on Sat Dec 16 12:25:15 GMT 2023 , Edited by admin on Sat Dec 16 12:25:15 GMT 2023
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FDA UNII
QC9YQ3S9RU
Created by admin on Sat Dec 16 12:25:15 GMT 2023 , Edited by admin on Sat Dec 16 12:25:15 GMT 2023
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CAS
6640-09-1
Created by admin on Sat Dec 16 12:25:15 GMT 2023 , Edited by admin on Sat Dec 16 12:25:15 GMT 2023
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ECHA (EC/EINECS)
229-652-6
Created by admin on Sat Dec 16 12:25:15 GMT 2023 , Edited by admin on Sat Dec 16 12:25:15 GMT 2023
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PUBCHEM
81146
Created by admin on Sat Dec 16 12:25:15 GMT 2023 , Edited by admin on Sat Dec 16 12:25:15 GMT 2023
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