6-ethoxy-4-oxidanylidene-N-[[3-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)phenyl]methyl]-1H-quinoline-3-carboxamide

Systemtic Name: 6-ethoxy-4-oxidanylidene-N-[[3-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)phenyl]methyl]-1H-quinoline-3-carboxamide Openeye Name: 6-ethoxy-4-oxo-N-[[3-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)phenyl]methyl]-1H-quinoline-3-carboxamide CAS Name: 6-ethoxy-4-oxo-N-[[3-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)phenyl]methyl]-1H-quinoline-3-carboxamide IUPAC Name: 6-ethoxy-4-oxo-N-[[3-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)phenyl]methyl]-1H-quinoline-3-carboxamide Traditional Name: 6-ethoxy-4-keto-N-[3-(1,2,3,4-tetrahydroisoquinolin-4-ylmethyl)benzyl]-1H-quinoline-3-carboxamide Formula: C29H29N3O3 MolecularWeight: 467.55886

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)NC=C(C2=O)C(=O)NCC3=CC=CC(=C3)CC4CNCC5=CC=CC=C45

Isomeric SMILES

CCOC1=CC2=C(C=C1)NC=C(C2=O)C(=O)NCC3=CC=CC(=C3)CC4CNCC5=CC=CC=C45

InChI

InChI=1S/C29H29N3O3/c1-2-35-23-10-11-27-25(14-23)28(33)26(18-31-27)29(34)32-15-20-7-5-6-19(12-20)13-22-17-30-16-21-8-3-4-9-24(21)22/h3-12,14,18,22,30H,2,13,15-17H2,1H3,(H,31,33)(H,32,34)