methyl 4-[[methyl-[1-(phenylsulfonyl)piperidin-2-yl]carbonyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[methyl-[1-(phenylsulfonyl)piperidin-2-yl]carbonyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[1-(benzenesulfonyl)piperidine-2-carbonyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[[1-(benzenesulfonyl)-2-piperidinyl]-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[1-(benzenesulfonyl)piperidine-2-carbonyl]-methylamino]methyl]benzoate Traditional Name: 4-[[(1-besylpipecoloyl)-methyl-amino]methyl]benzoic acid methyl ester Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2CCCCN2S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C22H26N2O5S/c1-23(16-17-11-13-18(14-12-17)22(26)29-2)21(25)20-10-6-7-15-24(20)30(27,28)19-8-4-3-5-9-19/h3-5,8-9,11-14,20H,6-7,10,15-16H2,1-2H3