1-[(3-ethoxyphenyl)methyl]-7-methoxy-6-oxidanylidene-2H-isoquinoline-4-carbaldehyde

Systemtic Name: 1-[(3-ethoxyphenyl)methyl]-7-methoxy-6-oxidanylidene-2H-isoquinoline-4-carbaldehyde Openeye Name: 1-[(3-ethoxyphenyl)methyl]-7-methoxy-6-oxo-2H-isoquinoline-4-carbaldehyde CAS Name: 1-[(3-ethoxyphenyl)methyl]-7-methoxy-6-oxo-2H-isoquinoline-4-carboxaldehyde IUPAC Name: 1-[(3-ethoxyphenyl)methyl]-7-methoxy-6-oxo-2H-isoquinoline-4-carbaldehyde Traditional Name: 1-(3-ethoxybenzyl)-6-keto-7-methoxy-2H-isoquinoline-4-carbaldehyde Formula: C20H19NO4 MolecularWeight: 337.36916

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC(=C1)CC2=C3C=C(C(=O)C=C3C(=CN2)C=O)OC

Isomeric SMILES

CCOC1=CC=CC(=C1)CC2=C3C=C(C(=O)C=C3C(=CN2)C=O)OC

InChI

InChI=1S/C20H19NO4/c1-3-25-15-6-4-5-13(7-15)8-18-17-10-20(24-2)19(23)9-16(17)14(12-22)11-21-18/h4-7,9-12,21H,3,8H2,1-2H3