methyl 1-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxylate

Systemtic Name: methyl 1-(4-methyl-3-pyrrolidin-1-ylsulfonyl-phenyl)carbonylpiperidine-4-carboxylate Openeye Name: methyl 1-(4-methyl-3-pyrrolidin-1-ylsulfonyl-benzoyl)piperidine-4-carboxylate CAS Name: 1-[[4-methyl-3-(1-pyrrolidinylsulfonyl)phenyl]-oxomethyl]-4-piperidinecarboxylic acid methyl ester IUPAC Name: methyl 1-(4-methyl-3-pyrrolidin-1-ylsulfonylbenzoyl)piperidine-4-carboxylate Traditional Name: 1-(4-methyl-3-pyrrolidinosulfonyl-benzoyl)isonipecotic acid methyl ester Formula: C19H26N2O5S MolecularWeight: 394.48514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)OC)S(=O)(=O)N3CCCC3

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC(CC2)C(=O)OC)S(=O)(=O)N3CCCC3

InChI

InChI=1S/C19H26N2O5S/c1-14-5-6-16(13-17(14)27(24,25)21-9-3-4-10-21)18(22)20-11-7-15(8-12-20)19(23)26-2/h5-6,13,15H,3-4,7-12H2,1-2H3