4-cyclopentylcarbonyl-7-nitro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one

Systemtic Name: 4-cyclopentylcarbonyl-7-nitro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Openeye Name: 4-(cyclopentanecarbonyl)-7-nitro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one CAS Name: 4-[cyclopentyl(oxo)methyl]-7-nitro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one IUPAC Name: 4-(cyclopentanecarbonyl)-7-nitro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Traditional Name: 4-(cyclopentanecarbonyl)-7-nitro-5-phenyl-3,5-dihydro-1H-1,4-benzodiazepin-2-one Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1CCC(C1)C(=O)N2CC(=O)NC3=C(C2C4=CC=CC=C4)C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N3O4/c25-19-13-23(21(26)15-8-4-5-9-15)20(14-6-2-1-3-7-14)17-12-16(24(27)28)10-11-18(17)22-19/h1-3,6-7,10-12,15,20H,4-5,8-9,13H2,(H,22,25)