methyl 9-methoxy-8-oxidanyl-1-thiophen-2-yl-pyrrolo[2,1-a]isoquinoline-3-carboxylate

Systemtic Name: methyl 9-methoxy-8-oxidanyl-1-thiophen-2-yl-pyrrolo[2,1-a]isoquinoline-3-carboxylate Openeye Name: methyl 8-hydroxy-9-methoxy-1-(2-thienyl)pyrrolo[2,1-a]isoquinoline-3-carboxylate CAS Name: 8-hydroxy-9-methoxy-1-thiophen-2-yl-3-pyrrolo[2,1-a]isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 8-hydroxy-9-methoxy-1-thiophen-2-ylpyrrolo[2,1-a]isoquinoline-3-carboxylate Traditional Name: 8-hydroxy-9-methoxy-1-(2-thienyl)pyrrol[2,1-a]isoquinoline-3-carboxylic acid methyl ester Formula: C19H15NO4S MolecularWeight: 353.3917

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C=CN3C(=CC(=C3C2=C1)C4=CC=CS4)C(=O)OC)O

Isomeric SMILES

COC1=C(C=C2C=CN3C(=CC(=C3C2=C1)C4=CC=CS4)C(=O)OC)O

InChI

InChI=1S/C19H15NO4S/c1-23-16-10-12-11(8-15(16)21)5-6-20-14(19(22)24-2)9-13(18(12)20)17-4-3-7-25-17/h3-10,21H,1-2H3