ethyl 6-chloranyl-2-methyl-1-oxidanylidene-4-propan-2-yloxy-isoquinoline-3-carboxylate

Systemtic Name: ethyl 6-chloranyl-2-methyl-1-oxidanylidene-4-propan-2-yloxy-isoquinoline-3-carboxylate Openeye Name: ethyl 6-chloro-4-isopropoxy-2-methyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 6-chloro-2-methyl-1-oxo-4-propan-2-yloxy-3-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6-chloro-2-methyl-1-oxo-4-propan-2-yloxyisoquinoline-3-carboxylate Traditional Name: 6-chloro-4-isopropoxy-1-keto-2-methyl-isoquinoline-3-carboxylic acid ethyl ester Formula: C16H18ClNO4 MolecularWeight: 323.77142

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1C)OC(C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(C=CC(=C2)Cl)C(=O)N1C)OC(C)C

InChI

InChI=1S/C16H18ClNO4/c1-5-21-16(20)13-14(22-9(2)3)12-8-10(17)6-7-11(12)15(19)18(13)4/h6-9H,5H2,1-4H3