2,4-DINITROPHENYLMORPHINE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C23H21N3O7
Molecular Weight	451.4287
Optical Activity	UNSPECIFIED
Defined Stereocenters	5 / 5
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[H][C@@]12OC3=C4C(C[C@H]5N(C)CC[C@@]14[C@@]5([H])C=C[C@@H]2O)=CC=C3OC6=C(C=C(C=C6)[N+]([O-])=O)[N+]([O-])=O

InChI

InChIKey=LRGWIFMZKBJNGI-KARMISDFSA-N

InChI=1S/C23H21N3O7/c1-24-9-8-23-14-4-5-17(27)22(23)33-21-19(6-2-12(20(21)23)10-15(14)24)32-18-7-3-13(25(28)29)11-16(18)26(30)31/h2-7,11,14-15,17,22,27H,8-10H2,1H3/t14-,15+,17-,22-,23-/m0/s1

HIDE SMILES / InChI

Molecular Formula	C23H21N3O7
Molecular Weight	451.4287
Charge	0
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	5 / 5
E/Z Centers	0
Optical Activity	UNSPECIFIED

Approval Year

Substance Class	Chemical Created by `admin` on `Sat Dec 16 18:15:27 GMT 2023` Edited by `admin` on `Sat Dec 16 18:15:27 GMT 2023`
Record UNII	9VEU59XV9R
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

2,4-DINITROPHENYLMORPHINE

Common Name

English

(5.ALPHA.,6.ALPHA.)-7,8-DIDEHYDRO-3-(2,4-DINITROPHENOXY)-4,5-EPOXY-17-METHYLMORPHINAN-6-OL

Systematic Name

English

MORPHINAN-6-OL, 7,8-DIDEHYDRO-3-(2,4-DINITROPHENOXY)-4,5-EPOXY-17-METHYL-, (5.ALPHA.,6.ALPHA.)-

Systematic Name

English

(4R,4aR,7S,7aR,12bS)-9-(2,4-dinitrophenoxy)-3-methyl-2,4,4a,7,7a,13-hexahydro-1H-4,12-methanobenzofuro[3,2-e]isoquinoline-7-ol

Systematic Name

English

Code System Code Type Description

WIKIPEDIA

2,4-Dinitrophenylmorphine