N-[[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]methyl]-4-nitro-benzamide

Systemtic Name: N-[[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]methyl]-4-nitro-benzamide Openeye Name: N-[[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]methyl]-4-nitro-benzamide CAS Name: N-[[1-(4-methoxyphenyl)sulfonyl-2-pyrrolidinyl]methyl]-4-nitrobenzamide IUPAC Name: N-[[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]methyl]-4-nitrobenzamide Traditional Name: N-[[1-(4-methoxyphenyl)sulfonylpyrrolidin-2-yl]methyl]-4-nitro-benzamide Formula: C19H21N3O6S MolecularWeight: 419.45154

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC2CNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)N2CCCC2CNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C19H21N3O6S/c1-28-17-8-10-18(11-9-17)29(26,27)21-12-2-3-16(21)13-20-19(23)14-4-6-15(7-5-14)22(24)25/h4-11,16H,2-3,12-13H2,1H3,(H,20,23)