6-butoxy-7-methoxy-1-(3-methoxyphenyl)carbonyl-isoquinoline-4-carbaldehyde

Systemtic Name: 6-butoxy-7-methoxy-1-(3-methoxyphenyl)carbonyl-isoquinoline-4-carbaldehyde Openeye Name: 6-butoxy-7-methoxy-1-(3-methoxybenzoyl)isoquinoline-4-carbaldehyde CAS Name: 6-butoxy-7-methoxy-1-[(3-methoxyphenyl)-oxomethyl]-4-isoquinolinecarboxaldehyde IUPAC Name: 6-butoxy-7-methoxy-1-(3-methoxybenzoyl)isoquinoline-4-carbaldehyde Traditional Name: 6-butoxy-1-m-anisoyl-7-methoxy-isoquinoline-4-carbaldehyde Formula: C23H23NO5 MolecularWeight: 393.43242

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C2C(=C1)C(=CN=C2C(=O)C3=CC(=CC=C3)OC)C=O)OC

Isomeric SMILES

CCCCOC1=C(C=C2C(=C1)C(=CN=C2C(=O)C3=CC(=CC=C3)OC)C=O)OC

InChI

InChI=1S/C23H23NO5/c1-4-5-9-29-21-11-18-16(14-25)13-24-22(19(18)12-20(21)28-3)23(26)15-7-6-8-17(10-15)27-2/h6-8,10-14H,4-5,9H2,1-3H3