N-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]-3-nitro-benzamide

Systemtic Name: N-[4-[4-(diphenylmethyl)piperazin-1-yl]sulfonylphenyl]-3-nitro-benzamide Openeye Name: N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-3-nitro-benzamide CAS Name: N-[4-[[4-(diphenylmethyl)-1-piperazinyl]sulfonyl]phenyl]-3-nitrobenzamide IUPAC Name: N-[4-(4-benzhydrylpiperazin-1-yl)sulfonylphenyl]-3-nitrobenzamide Traditional Name: N-[4-(4-benzhydrylpiperazino)sulfonylphenyl]-3-nitro-benzamide Formula: C30H28N4O5S MolecularWeight: 556.63212

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1C(C2=CC=CC=C2)C3=CC=CC=C3)S(=O)(=O)C4=CC=C(C=C4)NC(=O)C5=CC(=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C30H28N4O5S/c35-30(25-12-7-13-27(22-25)34(36)37)31-26-14-16-28(17-15-26)40(38,39)33-20-18-32(19-21-33)29(23-8-3-1-4-9-23)24-10-5-2-6-11-24/h1-17,22,29H,18-21H2,(H,31,35)