methyl 4-(2-chloranylpyridin-4-yl)-6,7-dimethoxy-isoquinoline-3-carboxylate

Systemtic Name: methyl 4-(2-chloranylpyridin-4-yl)-6,7-dimethoxy-isoquinoline-3-carboxylate Openeye Name: methyl 4-(2-chloro-4-pyridyl)-6,7-dimethoxy-isoquinoline-3-carboxylate CAS Name: 4-(2-chloro-4-pyridinyl)-6,7-dimethoxy-3-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 4-(2-chloropyridin-4-yl)-6,7-dimethoxyisoquinoline-3-carboxylate Traditional Name: 4-(2-chloro-4-pyridyl)-6,7-dimethoxy-isoquinoline-3-carboxylic acid methyl ester Formula: C18H15ClN2O4 MolecularWeight: 358.7757

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C=NC(=C2C3=CC(=NC=C3)Cl)C(=O)OC)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C=NC(=C2C3=CC(=NC=C3)Cl)C(=O)OC)OC

InChI

InChI=1S/C18H15ClN2O4/c1-23-13-6-11-9-21-17(18(22)25-3)16(12(11)8-14(13)24-2)10-4-5-20-15(19)7-10/h4-9H,1-3H3