ethyl 6,7-dimethoxy-1-[(3-propan-2-yloxyphenyl)methyl]isoquinoline-4-carboxylate

Systemtic Name: ethyl 6,7-dimethoxy-1-[(3-propan-2-yloxyphenyl)methyl]isoquinoline-4-carboxylate Openeye Name: ethyl 1-[(3-isopropoxyphenyl)methyl]-6,7-dimethoxy-isoquinoline-4-carboxylate CAS Name: 6,7-dimethoxy-1-[(3-propan-2-yloxyphenyl)methyl]-4-isoquinolinecarboxylic acid ethyl ester IUPAC Name: ethyl 6,7-dimethoxy-1-[(3-propan-2-yloxyphenyl)methyl]isoquinoline-4-carboxylate Traditional Name: 1-(3-isopropoxybenzyl)-6,7-dimethoxy-isoquinoline-4-carboxylic acid ethyl ester Formula: C24H27NO5 MolecularWeight: 409.47488

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CN=C(C2=CC(=C(C=C21)OC)OC)CC3=CC(=CC=C3)OC(C)C

Isomeric SMILES

CCOC(=O)C1=CN=C(C2=CC(=C(C=C21)OC)OC)CC3=CC(=CC=C3)OC(C)C

InChI

InChI=1S/C24H27NO5/c1-6-29-24(26)20-14-25-21(11-16-8-7-9-17(10-16)30-15(2)3)19-13-23(28-5)22(27-4)12-18(19)20/h7-10,12-15H,6,11H2,1-5H3