6,7-dimethoxy-2-methyl-3-(3-methylthiophen-2-yl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid

Systemtic Name: 6,7-dimethoxy-2-methyl-3-(3-methylthiophen-2-yl)-1-oxidanylidene-3,4-dihydroisoquinoline-4-carboxylic acid Openeye Name: 6,7-dimethoxy-2-methyl-3-(3-methyl-2-thienyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid CAS Name: 6,7-dimethoxy-2-methyl-3-(3-methyl-2-thiophenyl)-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid IUPAC Name: 6,7-dimethoxy-2-methyl-3-(3-methylthiophen-2-yl)-1-oxo-3,4-dihydroisoquinoline-4-carboxylic acid Traditional Name: 1-keto-6,7-dimethoxy-2-methyl-3-(3-methyl-2-thienyl)-3,4-dihydroisoquinoline-4-carboxylic acid Formula: C18H19NO5S MolecularWeight: 361.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(SC=C1)C2C(C3=CC(=C(C=C3C(=O)N2C)OC)OC)C(=O)O

Isomeric SMILES

CC1=C(SC=C1)C2C(C3=CC(=C(C=C3C(=O)N2C)OC)OC)C(=O)O

InChI

InChI=1S/C18H19NO5S/c1-9-5-6-25-16(9)15-14(18(21)22)10-7-12(23-3)13(24-4)8-11(10)17(20)19(15)2/h5-8,14-15H,1-4H3,(H,21,22)