3-(2,5-DIMETHYLPHENYL)-4-HYDROXY-8-METHOXY-1-AZASPIRO(4.5)DECAN-2-ONE, CIS-

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Details

Stereochemistry	UNKNOWN
Molecular Formula	C18H25NO3
Molecular Weight	303.396
Optical Activity	UNSPECIFIED
Defined Stereocenters	2 / 4
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 3-(2,5-DIMETHYLPHENYL)-4-HYDROXY-8-METHOXY-1-AZASPIRO(4.5)DECAN-2-ONE, CIS-

Structure Search

SMILES

CO[C@H]1CC[C@]2(CC1)NC(=O)C([C@@H]2O)C3=C(C)C=CC(C)=C3

InChI

InChIKey=HPQGJNTUXNUIDL-RMVSHPHESA-N

InChI=1S/C18H25NO3/c1-11-4-5-12(2)14(10-11)15-16(20)18(19-17(15)21)8-6-13(22-3)7-9-18/h4-5,10,13,15-16,20H,6-9H2,1-3H3,(H,19,21)/t13-,15?,16?,18+

HIDE SMILES / InChI

Molecular Formula	C18H25NO3
Molecular Weight	303.396
Charge	0
Count

Stereochemistry	EPIMERIC
Additional Stereochemistry	No
Defined Stereocenters	2 / 3
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 10:08:41 GMT 2023` Edited by `admin` on `Sat Dec 16 10:08:41 GMT 2023`
Record UNII	V2TN413993
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

3-(2,5-DIMETHYLPHENYL)-4-HYDROXY-8-METHOXY-1-AZASPIRO(4.5)DECAN-2-ONE, CIS-

Common Name

English

1-AZASPIRO(4.5)DECAN-2-ONE, 3-(2,5-DIMETHYLPHENYL)-4-HYDROXY-8-METHOXY-

Systematic Name

English

Code System Code Type Description

PUBCHEM

9879500

Created by admin on Sat Dec 16 10:08:41 GMT 2023 , Edited by admin on Sat Dec 16 10:08:41 GMT 2023

PRIMARY

CAS

1172134-12-1

Created by admin on Sat Dec 16 10:08:41 GMT 2023 , Edited by admin on Sat Dec 16 10:08:41 GMT 2023

PRIMARY

EPA CompTox

DTXSID70432253

Created by admin on Sat Dec 16 10:08:41 GMT 2023 , Edited by admin on Sat Dec 16 10:08:41 GMT 2023

PRIMARY

FDA UNII

V2TN413993

Created by admin on Sat Dec 16 10:08:41 GMT 2023 , Edited by admin on Sat Dec 16 10:08:41 GMT 2023

PRIMARY

CAS

1052102-59-6

Created by admin on Sat Dec 16 10:08:41 GMT 2023 , Edited by admin on Sat Dec 16 10:08:41 GMT 2023

NON-SPECIFIC STEREOCHEMISTRY