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

Systemtic Name: methyl 2-[4-[3-(4-aminocarbonylpiperidin-1-yl)propylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-[3-(4-carbamoyl-1-piperidyl)propylcarbamoyl]-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[[3-(4-carbamoyl-1-piperidinyl)propylamino]-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-[3-(4-carbamoylpiperidin-1-yl)propylcarbamoyl]piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-[3-(4-carbamoylpiperidino)propylcarbamoyl]piperidino]sulfonylbenzoic acid methyl ester Formula: C23H34N4O6S MolecularWeight: 494.60426

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NCCCN3CCC(CC3)C(=O)N

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NCCCN3CCC(CC3)C(=O)N

InChI

InChI=1S/C23H34N4O6S/c1-33-23(30)19-5-2-3-6-20(19)34(31,32)27-15-9-18(10-16-27)22(29)25-11-4-12-26-13-7-17(8-14-26)21(24)28/h2-3,5-6,17-18H,4,7-16H2,1H3,(H2,24,28)(H,25,29)