cyclopropyl-[4-[2-nitro-4-(phenylcarbonyl)phenyl]piperazin-1-yl]methanone

Systemtic Name: cyclopropyl-[4-[2-nitro-4-(phenylcarbonyl)phenyl]piperazin-1-yl]methanone Openeye Name: [4-(4-benzoyl-2-nitro-phenyl)piperazin-1-yl]-cyclopropyl-methanone CAS Name: [4-(4-benzoyl-2-nitrophenyl)-1-piperazinyl]-cyclopropylmethanone IUPAC Name: [4-(4-benzoyl-2-nitrophenyl)piperazin-1-yl]-cyclopropylmethanone Traditional Name: [4-(4-benzoyl-2-nitro-phenyl)piperazino]-cyclopropyl-methanone Formula: C21H21N3O4 MolecularWeight: 379.40914

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Descriptors Computed from Structure

Canonical SMILES:

C1CC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

Isomeric SMILES

C1CC1C(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)C4=CC=CC=C4)[N+](=O)[O-]

InChI

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