5-(2-methylprop-2-enyl)-10-nitro-6,11-dihydrobenzo[b][1,4]benzodiazepine

Systemtic Name: 5-(2-methylprop-2-enyl)-10-nitro-6,11-dihydrobenzo[b][1,4]benzodiazepine Openeye Name: 5-(2-methylallyl)-10-nitro-6,11-dihydrobenzo[b][1,4]benzodiazepine CAS Name: 5-(2-methylprop-2-enyl)-10-nitro-6,11-dihydrobenzo[b][1,4]benzodiazepine IUPAC Name: 5-(2-methylprop-2-enyl)-10-nitro-6,11-dihydrobenzo[b][1,4]benzodiazepine Traditional Name: 5-(2-methylallyl)-10-nitro-6,11-dihydrobenzo[b][1,4]benzodiazepine Formula: C17H17N3O2 MolecularWeight: 295.33578

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C)CN1CC2=C(C(=CC=C2)[N+](=O)[O-])NC3=CC=CC=C31

Isomeric SMILES

CC(=C)CN1CC2=C(C(=CC=C2)[N+](=O)[O-])NC3=CC=CC=C31

InChI

InChI=1S/C17H17N3O2/c1-12(2)10-19-11-13-6-5-9-16(20(21)22)17(13)18-14-7-3-4-8-15(14)19/h3-9,18H,1,10-11H2,2H3