6,7-dimethoxy-1-(3-propan-2-yloxyphenyl)carbonyl-isoquinoline-4-carbaldehyde

Systemtic Name: 6,7-dimethoxy-1-(3-propan-2-yloxyphenyl)carbonyl-isoquinoline-4-carbaldehyde Openeye Name: 1-(3-isopropoxybenzoyl)-6,7-dimethoxy-isoquinoline-4-carbaldehyde CAS Name: 6,7-dimethoxy-1-[oxo-(3-propan-2-yloxyphenyl)methyl]-4-isoquinolinecarboxaldehyde IUPAC Name: 6,7-dimethoxy-1-(3-propan-2-yloxybenzoyl)isoquinoline-4-carbaldehyde Traditional Name: 1-(3-isopropoxybenzoyl)-6,7-dimethoxy-isoquinoline-4-carbaldehyde Formula: C22H21NO5 MolecularWeight: 379.40584

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)C2=NC=C(C3=CC(=C(C=C32)OC)OC)C=O

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)C2=NC=C(C3=CC(=C(C=C32)OC)OC)C=O

InChI

InChI=1S/C22H21NO5/c1-13(2)28-16-7-5-6-14(8-16)22(25)21-18-10-20(27-4)19(26-3)9-17(18)15(12-24)11-23-21/h5-13H,1-4H3