4-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylamino]-3-nitro-N-(4-propan-2-ylphenyl)benzamide

Systemtic Name: 4-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylamino]-3-nitro-N-(4-propan-2-ylphenyl)benzamide Openeye Name: 4-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylamino]-N-(4-isopropylphenyl)-3-nitro-benzamide CAS Name: 4-[3-[4-(3-chlorophenyl)-1-piperazinyl]propylamino]-3-nitro-N-(4-propan-2-ylphenyl)benzamide IUPAC Name: 4-[3-[4-(3-chlorophenyl)piperazin-1-yl]propylamino]-3-nitro-N-(4-propan-2-ylphenyl)benzamide Traditional Name: 4-[3-[4-(3-chlorophenyl)piperazino]propylamino]-3-nitro-N-p-cumenyl-benzamide Formula: C29H34ClN5O3 MolecularWeight: 536.06496

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCCCN3CCN(CC3)C4=CC(=CC=C4)Cl)[N+](=O)[O-]

Isomeric SMILES

CC(C)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)NCCCN3CCN(CC3)C4=CC(=CC=C4)Cl)[N+](=O)[O-]

InChI

InChI=1S/C29H34ClN5O3/c1-21(2)22-7-10-25(11-8-22)32-29(36)23-9-12-27(28(19-23)35(37)38)31-13-4-14-33-15-17-34(18-16-33)26-6-3-5-24(30)20-26/h3,5-12,19-21,31H,4,13-18H2,1-2H3,(H,32,36)