methyl 2-[4-[3-[methyl-(phenylmethyl)amino]propylcarbamoyl]piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-[3-[methyl-(phenylmethyl)amino]propylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[3-[benzyl(methyl)amino]propylcarbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[3-[methyl-(phenylmethyl)amino]propylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[3-[benzyl(methyl)amino]propylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[3-[benzyl(methyl)amino]propylcarbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC)CC3=CC=CC=C3

Isomeric SMILES

CN(CCCNC(=O)C1CCN(CC1)S(=O)(=O)C2=CC=CC=C2C(=O)OC)CC3=CC=CC=C3

InChI

InChI=1S/C25H33N3O5S/c1-27(19-20-9-4-3-5-10-20)16-8-15-26-24(29)21-13-17-28(18-14-21)34(31,32)23-12-7-6-11-22(23)25(30)33-2/h3-7,9-12,21H,8,13-19H2,1-2H3,(H,26,29)