N-[(4-chlorophenyl)methyl]-5-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-nitro-aniline

Systemtic Name: N-[(4-chlorophenyl)methyl]-5-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-nitro-aniline Openeye Name: N-[(4-chlorophenyl)methyl]-5-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-nitro-aniline CAS Name: N-[(4-chlorophenyl)methyl]-5-[4-(4-chlorophenyl)sulfonyl-1-piperazinyl]-2-nitroaniline IUPAC Name: N-[(4-chlorophenyl)methyl]-5-[4-(4-chlorophenyl)sulfonylpiperazin-1-yl]-2-nitroaniline Traditional Name: (4-chlorobenzyl)-[5-[4-(4-chlorophenyl)sulfonylpiperazino]-2-nitro-phenyl]amine Formula: C23H22Cl2N4O4S MolecularWeight: 521.41618

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)Cl

Isomeric SMILES

C1CN(CCN1C2=CC(=C(C=C2)[N+](=O)[O-])NCC3=CC=C(C=C3)Cl)S(=O)(=O)C4=CC=C(C=C4)Cl

InChI

InChI=1S/C23H22Cl2N4O4S/c24-18-3-1-17(2-4-18)16-26-22-15-20(7-10-23(22)29(30)31)27-11-13-28(14-12-27)34(32,33)21-8-5-19(25)6-9-21/h1-10,15,26H,11-14,16H2