methyl 3-(3-hydroxyphenyl)sulfonyl-4-(pyridin-3-ylamino)butanoate

Systemtic Name: methyl 3-(3-hydroxyphenyl)sulfonyl-4-(pyridin-3-ylamino)butanoate Openeye Name: methyl 3-(3-hydroxyphenyl)sulfonyl-4-(3-pyridylamino)butanoate CAS Name: 3-(3-hydroxyphenyl)sulfonyl-4-(3-pyridinylamino)butanoic acid methyl ester IUPAC Name: methyl 3-(3-hydroxyphenyl)sulfonyl-4-(pyridin-3-ylamino)butanoate Traditional Name: 3-(3-hydroxyphenyl)sulfonyl-4-(3-pyridylamino)butyric acid methyl ester Formula: C16H18N2O5S MolecularWeight: 350.38952

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CC(CNC1=CN=CC=C1)S(=O)(=O)C2=CC=CC(=C2)O

Isomeric SMILES

COC(=O)CC(CNC1=CN=CC=C1)S(=O)(=O)C2=CC=CC(=C2)O

InChI

InChI=1S/C16H18N2O5S/c1-23-16(20)9-15(11-18-12-4-3-7-17-10-12)24(21,22)14-6-2-5-13(19)8-14/h2-8,10,15,18-19H,9,11H2,1H3