1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N-(3-nitrophenyl)piperidine-4-carboxamide

Systemtic Name: 1-(3-chloranyl-4-methoxy-phenyl)sulfonyl-N-(3-nitrophenyl)piperidine-4-carboxamide Openeye Name: 1-(3-chloro-4-methoxy-phenyl)sulfonyl-N-(3-nitrophenyl)piperidine-4-carboxamide CAS Name: 1-(3-chloro-4-methoxyphenyl)sulfonyl-N-(3-nitrophenyl)-4-piperidinecarboxamide IUPAC Name: 1-(3-chloro-4-methoxyphenyl)sulfonyl-N-(3-nitrophenyl)piperidine-4-carboxamide Traditional Name: 1-(3-chloro-4-methoxy-phenyl)sulfonyl-N-(3-nitrophenyl)isonipecotamide Formula: C19H20ClN3O6S MolecularWeight: 453.8966

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])Cl

Isomeric SMILES

COC1=C(C=C(C=C1)S(=O)(=O)N2CCC(CC2)C(=O)NC3=CC(=CC=C3)[N+](=O)[O-])Cl

InChI

InChI=1S/C19H20ClN3O6S/c1-29-18-6-5-16(12-17(18)20)30(27,28)22-9-7-13(8-10-22)19(24)21-14-3-2-4-15(11-14)23(25)26/h2-6,11-13H,7-10H2,1H3,(H,21,24)