3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-7-ethoxy-chromen-2-one

Systemtic Name: 3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-7-ethoxy-chromen-2-one Openeye Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-7-ethoxy-chromen-2-one CAS Name: 3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-7-ethoxy-1-benzopyran-2-one IUPAC Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-7-ethoxychromen-2-one Traditional Name: 3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-7-ethoxy-coumarin Formula: C21H19NO4 MolecularWeight: 349.37986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)N3CCC4=CC=CC=C4C3

Isomeric SMILES

CCOC1=CC2=C(C=C1)C=C(C(=O)O2)C(=O)N3CCC4=CC=CC=C4C3

InChI

InChI=1S/C21H19NO4/c1-2-25-17-8-7-15-11-18(21(24)26-19(15)12-17)20(23)22-10-9-14-5-3-4-6-16(14)13-22/h3-8,11-12H,2,9-10,13H2,1H3