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

Systemtic Name: 6-chloranyl-4-(3-methylbut-2-enyl)-9-nitro-1,2,3,5-tetrahydro-1,4-benzodiazepine Openeye Name: 6-chloro-4-(3-methylbut-2-enyl)-9-nitro-1,2,3,5-tetrahydro-1,4-benzodiazepine CAS Name: 6-chloro-4-(3-methylbut-2-enyl)-9-nitro-1,2,3,5-tetrahydro-1,4-benzodiazepine IUPAC Name: 6-chloro-4-(3-methylbut-2-enyl)-9-nitro-1,2,3,5-tetrahydro-1,4-benzodiazepine Traditional Name: 6-chloro-4-(3-methylbut-2-enyl)-9-nitro-1,2,3,5-tetrahydro-1,4-benzodiazepine Formula: C14H18ClN3O2 MolecularWeight: 295.76462

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Descriptors Computed from Structure

Canonical SMILES:

CC(=CCN1CCNC2=C(C=CC(=C2C1)Cl)[N+](=O)[O-])C

Isomeric SMILES

CC(=CCN1CCNC2=C(C=CC(=C2C1)Cl)[N+](=O)[O-])C

InChI

InChI=1S/C14H18ClN3O2/c1-10(2)5-7-17-8-6-16-14-11(9-17)12(15)3-4-13(14)18(19)20/h3-5,16H,6-9H2,1-2H3