ethyl 4-butoxy-6,7-bis(chloranyl)-1-oxidanylidene-2-propan-2-yl-isoquinoline-3-carboxylate

Systemtic Name: ethyl 4-butoxy-6,7-bis(chloranyl)-1-oxidanylidene-2-propan-2-yl-isoquinoline-3-carboxylate Openeye Name: ethyl 4-butoxy-6,7-dichloro-2-isopropyl-1-oxo-isoquinoline-3-carboxylate CAS Name: 4-butoxy-6,7-dichloro-1-oxo-2-propan-2-yl-3-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-butoxy-6,7-dichloro-1-oxo-2-propan-2-ylisoquinoline-3-carboxylate Traditional Name: 4-butoxy-6,7-dichloro-2-isopropyl-1-keto-isoquinoline-3-carboxylic acid ethyl ester Formula: C19H23Cl2NO4 MolecularWeight: 400.29622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(N(C(=O)C2=CC(=C(C=C21)Cl)Cl)C(C)C)C(=O)OCC

Isomeric SMILES

CCCCOC1=C(N(C(=O)C2=CC(=C(C=C21)Cl)Cl)C(C)C)C(=O)OCC

InChI

InChI=1S/C19H23Cl2NO4/c1-5-7-8-26-17-12-9-14(20)15(21)10-13(12)18(23)22(11(3)4)16(17)19(24)25-6-2/h9-11H,5-8H2,1-4H3