2-(4-ethoxyphenyl)-6,7-dimethoxy-N-(3-morpholin-4-ylpropyl)-1-oxidanylidene-isoquinoline-4-carboxamide

Systemtic Name: 2-(4-ethoxyphenyl)-6,7-dimethoxy-N-(3-morpholin-4-ylpropyl)-1-oxidanylidene-isoquinoline-4-carboxamide Openeye Name: 2-(4-ethoxyphenyl)-6,7-dimethoxy-N-(3-morpholinopropyl)-1-oxo-isoquinoline-4-carboxamide CAS Name: 2-(4-ethoxyphenyl)-6,7-dimethoxy-N-[3-(4-morpholinyl)propyl]-1-oxo-4-isoquinolinecarboxamide IUPAC Name: 2-(4-ethoxyphenyl)-6,7-dimethoxy-N-(3-morpholin-4-ylpropyl)-1-oxoisoquinoline-4-carboxamide Traditional Name: 1-keto-6,7-dimethoxy-N-(3-morpholinopropyl)-2-p-phenetyl-isoquinoline-4-carboxamide Formula: C27H33N3O6 MolecularWeight: 495.56742

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)N2C=C(C3=CC(=C(C=C3C2=O)OC)OC)C(=O)NCCCN4CCOCC4

Isomeric SMILES

CCOC1=CC=C(C=C1)N2C=C(C3=CC(=C(C=C3C2=O)OC)OC)C(=O)NCCCN4CCOCC4

InChI

InChI=1S/C27H33N3O6/c1-4-36-20-8-6-19(7-9-20)30-18-23(26(31)28-10-5-11-29-12-14-35-15-13-29)21-16-24(33-2)25(34-3)17-22(21)27(30)32/h6-9,16-18H,4-5,10-15H2,1-3H3,(H,28,31)