N-[1-(6,7-dimethoxyisoquinolin-4-yl)-2-oxidanylidene-2-(3-propan-2-yloxyphenyl)ethyl]pyridine-4-carboxamide

Systemtic Name: N-[1-(6,7-dimethoxyisoquinolin-4-yl)-2-oxidanylidene-2-(3-propan-2-yloxyphenyl)ethyl]pyridine-4-carboxamide Openeye Name: N-[1-(6,7-dimethoxy-4-isoquinolyl)-2-(3-isopropoxyphenyl)-2-oxo-ethyl]pyridine-4-carboxamide CAS Name: N-[1-(6,7-dimethoxy-4-isoquinolinyl)-2-oxo-2-(3-propan-2-yloxyphenyl)ethyl]-4-pyridinecarboxamide IUPAC Name: N-[1-(6,7-dimethoxyisoquinolin-4-yl)-2-oxo-2-(3-propan-2-yloxyphenyl)ethyl]pyridine-4-carboxamide Traditional Name: N-[1-(6,7-dimethoxy-4-isoquinolyl)-2-(3-isopropoxyphenyl)-2-keto-ethyl]isonicotinamide Formula: C28H27N3O5 MolecularWeight: 485.53108

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)OC1=CC=CC(=C1)C(=O)C(C2=CN=CC3=CC(=C(C=C32)OC)OC)NC(=O)C4=CC=NC=C4

Isomeric SMILES

CC(C)OC1=CC=CC(=C1)C(=O)C(C2=CN=CC3=CC(=C(C=C32)OC)OC)NC(=O)C4=CC=NC=C4

InChI

InChI=1S/C28H27N3O5/c1-17(2)36-21-7-5-6-19(12-21)27(32)26(31-28(33)18-8-10-29-11-9-18)23-16-30-15-20-13-24(34-3)25(35-4)14-22(20)23/h5-17,26H,1-4H3,(H,31,33)