N-butan-2-yl-1-[4-(methylamino)-3-nitro-phenyl]sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide

Systemtic Name: N-butan-2-yl-1-[4-(methylamino)-3-nitro-phenyl]sulfonyl-N-(phenylmethyl)piperidine-4-carboxamide Openeye Name: N-benzyl-1-[4-(methylamino)-3-nitro-phenyl]sulfonyl-N-sec-butyl-piperidine-4-carboxamide CAS Name: N-butan-2-yl-1-[4-(methylamino)-3-nitrophenyl]sulfonyl-N-(phenylmethyl)-4-piperidinecarboxamide IUPAC Name: N-benzyl-N-butan-2-yl-1-[4-(methylamino)-3-nitrophenyl]sulfonylpiperidine-4-carboxamide Traditional Name: N-benzyl-1-[4-(methylamino)-3-nitro-phenyl]sulfonyl-N-sec-butyl-isonipecotamide Formula: C24H32N4O5S MolecularWeight: 488.59968

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)N(CC1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

Isomeric SMILES

CCC(C)N(CC1=CC=CC=C1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC(=C(C=C3)NC)[N+](=O)[O-]

InChI

InChI=1S/C24H32N4O5S/c1-4-18(2)27(17-19-8-6-5-7-9-19)24(29)20-12-14-26(15-13-20)34(32,33)21-10-11-22(25-3)23(16-21)28(30)31/h5-11,16,18,20,25H,4,12-15,17H2,1-3H3