1-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid

Systemtic Name: 1-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Openeye Name: 1-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid CAS Name: 1-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid IUPAC Name: 1-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Traditional Name: 1-(4-methoxyphenyl)sulfonyl-1,2,3,4-tetrahydroisoquinoline-3-carboxylic acid Formula: C17H17NO5S MolecularWeight: 347.38558

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)S(=O)(=O)C2C3=CC=CC=C3CC(N2)C(=O)O

Isomeric SMILES

COC1=CC=C(C=C1)S(=O)(=O)C2C3=CC=CC=C3CC(N2)C(=O)O

InChI

InChI=1S/C17H17NO5S/c1-23-12-6-8-13(9-7-12)24(21,22)16-14-5-3-2-4-11(14)10-15(18-16)17(19)20/h2-9,15-16,18H,10H2,1H3,(H,19,20)