4-(3-methylbut-2-enyl)-9-nitro-5-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine

Systemtic Name: 4-(3-methylbut-2-enyl)-9-nitro-5-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine Openeye Name: 4-(3-methylbut-2-enyl)-9-nitro-5-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine CAS Name: 4-(3-methylbut-2-enyl)-9-nitro-5-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine IUPAC Name: 4-(3-methylbut-2-enyl)-9-nitro-5-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine Traditional Name: 4-(3-methylbut-2-enyl)-9-nitro-5-phenyl-1,2,3,5-tetrahydro-1,4-benzodiazepine Formula: C20H23N3O2 MolecularWeight: 337.41552

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1CCNC2=C(C1C3=CC=CC=C3)C=CC=C2[N+](=O)[O-])C

Isomeric SMILES

CC(=CCN1CCNC2=C(C1C3=CC=CC=C3)C=CC=C2[N+](=O)[O-])C

InChI

InChI=1S/C20H23N3O2/c1-15(2)11-13-22-14-12-21-19-17(9-6-10-18(19)23(24)25)20(22)16-7-4-3-5-8-16/h3-11,20-21H,12-14H2,1-2H3