6,7-dimethoxy-2-oxidanyl-4-oxidanylidene-1-prop-2-enyl-N-(pyridin-4-ylmethyl)quinoline-3-carboxamide

Systemtic Name: 6,7-dimethoxy-2-oxidanyl-4-oxidanylidene-1-prop-2-enyl-N-(pyridin-4-ylmethyl)quinoline-3-carboxamide Openeye Name: 1-allyl-2-hydroxy-6,7-dimethoxy-4-oxo-N-(4-pyridylmethyl)quinoline-3-carboxamide CAS Name: 2-hydroxy-6,7-dimethoxy-4-oxo-1-prop-2-enyl-N-(pyridin-4-ylmethyl)-3-quinolinecarboxamide IUPAC Name: 2-hydroxy-6,7-dimethoxy-4-oxo-1-prop-2-enyl-N-(pyridin-4-ylmethyl)quinoline-3-carboxamide Traditional Name: 1-allyl-2-hydroxy-4-keto-6,7-dimethoxy-N-(4-pyridylmethyl)quinoline-3-carboxamide Formula: C21H21N3O5 MolecularWeight: 395.40854

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(=C1)C(=O)C(=C(N2CC=C)O)C(=O)NCC3=CC=NC=C3)OC

Isomeric SMILES

COC1=C(C=C2C(=C1)C(=O)C(=C(N2CC=C)O)C(=O)NCC3=CC=NC=C3)OC

InChI

InChI=1S/C21H21N3O5/c1-4-9-24-15-11-17(29-3)16(28-2)10-14(15)19(25)18(21(24)27)20(26)23-12-13-5-7-22-8-6-13/h4-8,10-11,27H,1,9,12H2,2-3H3,(H,23,26)