N-(3-chloranyl-4-methoxy-phenyl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanamide

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]ethanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]acetamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[4-(3-nitrophenyl)sulfonyl-1-piperazinyl]acetamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-[4-(3-nitrophenyl)sulfonylpiperazin-1-yl]acetamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[4-(3-nitrophenyl)sulfonylpiperazino]acetamide Formula: C19H21ClN4O6S MolecularWeight: 468.91124

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2CCN(CC2)S(=O)(=O)C3=CC=CC(=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H21ClN4O6S/c1-30-18-6-5-14(11-17(18)20)21-19(25)13-22-7-9-23(10-8-22)31(28,29)16-4-2-3-15(12-16)24(26)27/h2-6,11-12H,7-10,13H2,1H3,(H,21,25)