2-[[4-(4-methoxyphenyl)phenyl]sulfonyl-methyl-amino]-2-(1-morpholin-4-ylpiperidin-4-yl)ethanoic acid

Systemtic Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonyl-methyl-amino]-2-(1-morpholin-4-ylpiperidin-4-yl)ethanoic acid Openeye Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonyl-methyl-amino]-2-(1-morpholino-4-piperidyl)acetic acid CAS Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonyl-methylamino]-2-[1-(4-morpholinyl)-4-piperidinyl]acetic acid IUPAC Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonyl-methylamino]-2-(1-morpholin-4-ylpiperidin-4-yl)acetic acid Traditional Name: 2-[[4-(4-methoxyphenyl)phenyl]sulfonyl-methyl-amino]-2-(1-morpholino-4-piperidyl)acetic acid Formula: C25H33N3O6S MolecularWeight: 503.61102

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Descriptors Computed from Structure

Canonical SMILES:

CN(C(C1CCN(CC1)N2CCOCC2)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)OC

Isomeric SMILES

CN(C(C1CCN(CC1)N2CCOCC2)C(=O)O)S(=O)(=O)C3=CC=C(C=C3)C4=CC=C(C=C4)OC

InChI

InChI=1S/C25H33N3O6S/c1-26(24(25(29)30)21-11-13-27(14-12-21)28-15-17-34-18-16-28)35(31,32)23-9-5-20(6-10-23)19-3-7-22(33-2)8-4-19/h3-10,21,24H,11-18H2,1-2H3,(H,29,30)