[3-(3-methoxyphenyl)isoquinolin-4-yl]methyl thiophene-2-carboxylate

Systemtic Name: [3-(3-methoxyphenyl)isoquinolin-4-yl]methyl thiophene-2-carboxylate Openeye Name: [3-(3-methoxyphenyl)-4-isoquinolyl]methyl thiophene-2-carboxylate CAS Name: 2-thiophenecarboxylic acid [3-(3-methoxyphenyl)-4-isoquinolinyl]methyl ester IUPAC Name: [3-(3-methoxyphenyl)isoquinolin-4-yl]methyl thiophene-2-carboxylate Traditional Name: thiophene-2-carboxylic acid [3-(3-methoxyphenyl)-4-isoquinolyl]methyl ester Formula: C22H17NO3S MolecularWeight: 375.44028

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1)C2=C(C3=CC=CC=C3C=N2)COC(=O)C4=CC=CS4

Isomeric SMILES

COC1=CC=CC(=C1)C2=C(C3=CC=CC=C3C=N2)COC(=O)C4=CC=CS4

InChI

InChI=1S/C22H17NO3S/c1-25-17-8-4-7-15(12-17)21-19(14-26-22(24)20-10-5-11-27-20)18-9-3-2-6-16(18)13-23-21/h2-13H,14H2,1H3