N-cyclohexyl-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]propanamide

Systemtic Name: N-cyclohexyl-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]propanamide Openeye Name: N-cyclohexyl-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazin-1-yl]propanamide CAS Name: N-cyclohexyl-2-[4-(4-methoxy-3-nitrophenyl)sulfonyl-1-piperazinyl]propanamide IUPAC Name: N-cyclohexyl-2-[4-(4-methoxy-3-nitrophenyl)sulfonylpiperazin-1-yl]propanamide Traditional Name: N-cyclohexyl-2-[4-(4-methoxy-3-nitro-phenyl)sulfonylpiperazino]propionamide Formula: C20H30N4O6S MolecularWeight: 454.5404

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1CCCCC1)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1CCCCC1)N2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)OC)[N+](=O)[O-]

InChI

InChI=1S/C20H30N4O6S/c1-15(20(25)21-16-6-4-3-5-7-16)22-10-12-23(13-11-22)31(28,29)17-8-9-19(30-2)18(14-17)24(26)27/h8-9,14-16H,3-7,10-13H2,1-2H3,(H,21,25)