EM-012

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C22H24BrNO6
Molecular Weight	478.333
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 2
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]1(OCC2=C1C=CC(OC)=C2OC)[C@]3([H])N(C)CCC4=C(Br)C5=C(OCO5)C(OC)=C34

InChI

InChIKey=VVSDXCUYQGHQTE-MJGOQNOKSA-N

InChI=1S/C22H24BrNO6/c1-24-8-7-12-15(20(27-4)22-21(16(12)23)29-10-30-22)17(24)19-11-5-6-14(25-2)18(26-3)13(11)9-28-19/h5-6,17,19H,7-10H2,1-4H3/t17-,19+/m1/s1

HIDE SMILES / InChI

Molecular Formula	C22H24BrNO6
Molecular Weight	478.333
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	2 / 2
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 08:28:31 GMT 2023` Edited by `admin` on `Sat Dec 16 08:28:31 GMT 2023`
Record UNII	74K735LP9T
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

EM-012

Common Name

English

1,3-DIOXOLO(4,5-G)ISOQUINOLINE, 9-BROMO-5-((1S)-1,3-DIHYDRO-4,5-DIMETHOXY-1-ISOBENZOFURANYL)-5,6,7,8-TETRAHYDRO-4-METHOXY-6-METHYL-, (5R)-

Systematic Name

English

Code System Code Type Description

CAS

565418-40-8

Created by admin on Sat Dec 16 08:28:31 GMT 2023 , Edited by admin on Sat Dec 16 08:28:31 GMT 2023

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FDA UNII

74K735LP9T

Created by admin on Sat Dec 16 08:28:31 GMT 2023 , Edited by admin on Sat Dec 16 08:28:31 GMT 2023

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PUBCHEM

10050740

Created by admin on Sat Dec 16 08:28:31 GMT 2023 , Edited by admin on Sat Dec 16 08:28:31 GMT 2023

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Related Record Type Details


					74K735LP9T

EM-012

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