2-[[phenyl(3-piperidin-4-ylpropoxy)methyl]-(phenylsulfonyl)amino]ethanoic acid

Systemtic Name: 2-[[phenyl(3-piperidin-4-ylpropoxy)methyl]-(phenylsulfonyl)amino]ethanoic acid Openeye Name: 2-[benzenesulfonyl-[phenyl-[3-(4-piperidyl)propoxy]methyl]amino]acetic acid CAS Name: 2-[benzenesulfonyl-[phenyl-[3-(4-piperidinyl)propoxy]methyl]amino]acetic acid IUPAC Name: 2-[benzenesulfonyl-[phenyl(3-piperidin-4-ylpropoxy)methyl]amino]acetic acid Traditional Name: 2-[besyl-[phenyl-[3-(4-piperidyl)propoxy]methyl]amino]acetic acid Formula: C23H30N2O5S MolecularWeight: 446.5597

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCC1CCCOC(C2=CC=CC=C2)N(CC(=O)O)S(=O)(=O)C3=CC=CC=C3

Isomeric SMILES

C1CNCCC1CCCOC(C2=CC=CC=C2)N(CC(=O)O)S(=O)(=O)C3=CC=CC=C3

InChI

InChI=1S/C23H30N2O5S/c26-22(27)18-25(31(28,29)21-11-5-2-6-12-21)23(20-9-3-1-4-10-20)30-17-7-8-19-13-15-24-16-14-19/h1-6,9-12,19,23-24H,7-8,13-18H2,(H,26,27)