(5-ethoxycarbonyl-2-piperidin-1-yl-phenyl)-(2-nitrophenyl)sulfonyl-azanide

Systemtic Name: (5-ethoxycarbonyl-2-piperidin-1-yl-phenyl)-(2-nitrophenyl)sulfonyl-azanide Openeye Name: [5-ethoxycarbonyl-2-(1-piperidyl)phenyl]-(2-nitrophenyl)sulfonyl-azanide CAS Name: [5-ethoxycarbonyl-2-(1-piperidinyl)phenyl]-(2-nitrophenyl)sulfonylazanide IUPAC Name: (5-ethoxycarbonyl-2-piperidin-1-ylphenyl)-(2-nitrophenyl)sulfonylazanide Traditional Name: (5-carbethoxy-2-piperidino-phenyl)-(2-nitrophenyl)sulfonyl-azanide Formula: C20H22N3O6S- MolecularWeight: 432.47018

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N2CCCCC2)[N-]S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N2CCCCC2)[N-]S(=O)(=O)C3=CC=CC=C3[N+](=O)[O-]

InChI

InChI=1S/C20H22N3O6S/c1-2-29-20(24)15-10-11-17(22-12-6-3-7-13-22)16(14-15)21-30(27,28)19-9-5-4-8-18(19)23(25)26/h4-5,8-11,14H,2-3,6-7,12-13H2,1H3/q-1