N-cyclopropyl-4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitro-benzamide

Systemtic Name: N-cyclopropyl-4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitro-benzamide Openeye Name: N-cyclopropyl-4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitro-benzamide CAS Name: N-cyclopropyl-4-[4-(4-ethoxyphenyl)sulfonyl-1-piperazinyl]-3-nitrobenzamide IUPAC Name: N-cyclopropyl-4-[4-(4-ethoxyphenyl)sulfonylpiperazin-1-yl]-3-nitrobenzamide Traditional Name: N-cyclopropyl-3-nitro-4-(4-p-phenetylsulfonylpiperazino)benzamide Formula: C22H26N4O6S MolecularWeight: 474.53004

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CC4)[N+](=O)[O-]

Isomeric SMILES

CCOC1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C3=C(C=C(C=C3)C(=O)NC4CC4)[N+](=O)[O-]

InChI

InChI=1S/C22H26N4O6S/c1-2-32-18-6-8-19(9-7-18)33(30,31)25-13-11-24(12-14-25)20-10-3-16(15-21(20)26(28)29)22(27)23-17-4-5-17/h3,6-10,15,17H,2,4-5,11-14H2,1H3,(H,23,27)