[4-[4-nitro-3-(4-phenylpiperazin-1-yl)phenyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone

Systemtic Name: [4-[4-nitro-3-(4-phenylpiperazin-1-yl)phenyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone Openeye Name: (4-isopropylphenyl)-[4-[4-nitro-3-(4-phenylpiperazin-1-yl)phenyl]piperazin-1-yl]methanone CAS Name: [4-[4-nitro-3-(4-phenyl-1-piperazinyl)phenyl]-1-piperazinyl]-(4-propan-2-ylphenyl)methanone IUPAC Name: [4-[4-nitro-3-(4-phenylpiperazin-1-yl)phenyl]piperazin-1-yl]-(4-propan-2-ylphenyl)methanone Traditional Name: [4-[4-nitro-3-(4-phenylpiperazino)phenyl]piperazino]-p-cumenyl-methanone Formula: C30H35N5O3 MolecularWeight: 513.6306

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCN(CC4)C5=CC=CC=C5

Isomeric SMILES

CC(C)C1=CC=C(C=C1)C(=O)N2CCN(CC2)C3=CC(=C(C=C3)[N+](=O)[O-])N4CCN(CC4)C5=CC=CC=C5

InChI

InChI=1S/C30H35N5O3/c1-23(2)24-8-10-25(11-9-24)30(36)34-20-16-32(17-21-34)27-12-13-28(35(37)38)29(22-27)33-18-14-31(15-19-33)26-6-4-3-5-7-26/h3-13,22-23H,14-21H2,1-2H3