1-[4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-3-nitro-phenyl]piperidine-2,6-dione

Systemtic Name: 1-[4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-3-nitro-phenyl]piperidine-2,6-dione Openeye Name: 1-[4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazin-1-yl]-3-nitro-phenyl]piperidine-2,6-dione CAS Name: 1-[4-[4-[(4-chlorophenyl)-phenylmethyl]-1-piperazinyl]-3-nitrophenyl]piperidine-2,6-dione IUPAC Name: 1-[4-[4-[(4-chlorophenyl)-phenylmethyl]piperazin-1-yl]-3-nitrophenyl]piperidine-2,6-dione Traditional Name: 1-[4-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino]-3-nitro-phenyl]piperidine-2,6-quinone Formula: C28H27ClN4O4 MolecularWeight: 518.99138

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=O)N(C(=O)C1)C2=CC(=C(C=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl)[N+](=O)[O-]

Isomeric SMILES

C1CC(=O)N(C(=O)C1)C2=CC(=C(C=C2)N3CCN(CC3)C(C4=CC=CC=C4)C5=CC=C(C=C5)Cl)[N+](=O)[O-]

InChI

InChI=1S/C28H27ClN4O4/c29-22-11-9-21(10-12-22)28(20-5-2-1-3-6-20)31-17-15-30(16-18-31)24-14-13-23(19-25(24)33(36)37)32-26(34)7-4-8-27(32)35/h1-3,5-6,9-14,19,28H,4,7-8,15-18H2