N-[1-(2-methoxyphenyl)ethyl]-N-methyl-1-[4-(methylamino)-3-nitro-phenyl]sulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(2-methoxyphenyl)ethyl]-N-methyl-1-[4-(methylamino)-3-nitro-phenyl]sulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(2-methoxyphenyl)ethyl]-N-methyl-1-[4-(methylamino)-3-nitro-phenyl]sulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(2-methoxyphenyl)ethyl]-N-methyl-1-[4-(methylamino)-3-nitrophenyl]sulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(2-methoxyphenyl)ethyl]-N-methyl-1-[4-(methylamino)-3-nitrophenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(2-methoxyphenyl)ethyl]-N-methyl-1-[4-(methylamino)-3-nitro-phenyl]sulfonyl-isonipecotamide Formula: C23H30N4O6S MolecularWeight: 490.5725

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1OC)N(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=CC=C1OC)N(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

InChI

InChI=1S/C23H30N4O6S/c1-16(19-7-5-6-8-22(19)33-4)25(3)23(28)17-11-13-26(14-12-17)34(31,32)18-9-10-20(24-2)21(15-18)27(29)30/h5-10,15-17,24H,11-14H2,1-4H3