2-methyl-7-nitro-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepin-3-one

Systemtic Name: 2-methyl-7-nitro-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepin-3-one Openeye Name: 2-methyl-7-nitro-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepin-3-one CAS Name: 2-methyl-7-nitro-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepin-3-one IUPAC Name: 2-methyl-7-nitro-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepin-3-one Traditional Name: 2-methyl-7-nitro-4-phenethyl-2,5-dihydro-1H-1,4-benzodiazepin-3-one Formula: C18H19N3O3 MolecularWeight: 325.36176

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(CC2=C(N1)C=CC(=C2)[N+](=O)[O-])CCC3=CC=CC=C3

Isomeric SMILES

CC1C(=O)N(CC2=C(N1)C=CC(=C2)[N+](=O)[O-])CCC3=CC=CC=C3

InChI

InChI=1S/C18H19N3O3/c1-13-18(22)20(10-9-14-5-3-2-4-6-14)12-15-11-16(21(23)24)7-8-17(15)19-13/h2-8,11,13,19H,9-10,12H2,1H3