5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-2-nitro-N-(phenylmethyl)aniline

Systemtic Name: 5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-2-nitro-N-(phenylmethyl)aniline Openeye Name: N-benzyl-5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-2-nitro-aniline CAS Name: 5-[4-(3,4-dichlorophenyl)sulfonyl-1-piperazinyl]-2-nitro-N-(phenylmethyl)aniline IUPAC Name: N-benzyl-5-[4-(3,4-dichlorophenyl)sulfonylpiperazin-1-yl]-2-nitroaniline Traditional Name: benzyl-[5-[4-(3,4-dichlorophenyl)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=CC=C3)S(=O)(=O)C4=CC(=C(C=C4)Cl)Cl

Isomeric SMILES

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

InChI

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