2-[6-methoxy-3-(phenylmethoxycarbonylamino)pyridin-2-yl]-2-(4-methylphenyl)sulfonyl-ethanoic acid

Systemtic Name: 2-[6-methoxy-3-(phenylmethoxycarbonylamino)pyridin-2-yl]-2-(4-methylphenyl)sulfonyl-ethanoic acid Openeye Name: 2-[3-(benzyloxycarbonylamino)-6-methoxy-2-pyridyl]-2-(p-tolylsulfonyl)acetic acid CAS Name: 2-[6-methoxy-3-(phenylmethoxycarbonylamino)-2-pyridinyl]-2-(4-methylphenyl)sulfonylacetic acid IUPAC Name: 2-[6-methoxy-3-(phenylmethoxycarbonylamino)pyridin-2-yl]-2-(4-methylphenyl)sulfonylacetic acid Traditional Name: 2-[3-(benzyloxycarbonylamino)-6-methoxy-2-pyridyl]-2-tosyl-acetic acid Formula: C23H22N2O7S MolecularWeight: 470.49498

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)S(=O)(=O)C(C2=C(C=CC(=N2)OC)NC(=O)OCC3=CC=CC=C3)C(=O)O

Isomeric SMILES

CC1=CC=C(C=C1)S(=O)(=O)C(C2=C(C=CC(=N2)OC)NC(=O)OCC3=CC=CC=C3)C(=O)O

InChI

InChI=1S/C23H22N2O7S/c1-15-8-10-17(11-9-15)33(29,30)21(22(26)27)20-18(12-13-19(25-20)31-2)24-23(28)32-14-16-6-4-3-5-7-16/h3-13,21H,14H2,1-2H3,(H,24,28)(H,26,27)