(3-chlorophenyl)-[4-[4-nitro-3-(4-phenylpiperazin-1-yl)phenyl]piperazin-1-yl]methanone

Systemtic Name: (3-chlorophenyl)-[4-[4-nitro-3-(4-phenylpiperazin-1-yl)phenyl]piperazin-1-yl]methanone Openeye Name: (3-chlorophenyl)-[4-[4-nitro-3-(4-phenylpiperazin-1-yl)phenyl]piperazin-1-yl]methanone CAS Name: (3-chlorophenyl)-[4-[4-nitro-3-(4-phenyl-1-piperazinyl)phenyl]-1-piperazinyl]methanone IUPAC Name: (3-chlorophenyl)-[4-[4-nitro-3-(4-phenylpiperazin-1-yl)phenyl]piperazin-1-yl]methanone Traditional Name: (3-chlorophenyl)-[4-[4-nitro-3-(4-phenylpiperazino)phenyl]piperazino]methanone Formula: C27H28ClN5O3 MolecularWeight: 505.99592

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC=CC=C2)C3=C(C=CC(=C3)N4CCN(CC4)C(=O)C5=CC(=CC=C5)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C2=CC=CC=C2)C3=C(C=CC(=C3)N4CCN(CC4)C(=O)C5=CC(=CC=C5)Cl)[N+](=O)[O-]

InChI

InChI=1S/C27H28ClN5O3/c28-22-6-4-5-21(19-22)27(34)32-17-13-30(14-18-32)24-9-10-25(33(35)36)26(20-24)31-15-11-29(12-16-31)23-7-2-1-3-8-23/h1-10,19-20H,11-18H2