methyl 1-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]isoquinoline-4-carboxylate

Systemtic Name: methyl 1-[(5-chloranyl-2,4-dimethoxy-phenyl)amino]isoquinoline-4-carboxylate Openeye Name: methyl 1-(5-chloro-2,4-dimethoxy-anilino)isoquinoline-4-carboxylate CAS Name: 1-(5-chloro-2,4-dimethoxyanilino)-4-isoquinolinecarboxylic acid methyl ester IUPAC Name: methyl 1-(5-chloro-2,4-dimethoxyanilino)isoquinoline-4-carboxylate Traditional Name: 1-(5-chloro-2,4-dimethoxy-anilino)isoquinoline-4-carboxylic acid methyl ester Formula: C19H17ClN2O4 MolecularWeight: 372.80228

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1NC2=NC=C(C3=CC=CC=C32)C(=O)OC)Cl)OC

Isomeric SMILES

COC1=CC(=C(C=C1NC2=NC=C(C3=CC=CC=C32)C(=O)OC)Cl)OC

InChI

InChI=1S/C19H17ClN2O4/c1-24-16-9-17(25-2)15(8-14(16)20)22-18-12-7-5-4-6-11(12)13(10-21-18)19(23)26-3/h4-10H,1-3H3,(H,21,22)