6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-4,7-dimethyl-chromen-2-one

Systemtic Name: 6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxidanylidene-ethoxy]-4,7-dimethyl-chromen-2-one Openeye Name: 6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxo-ethoxy]-4,7-dimethyl-chromen-2-one CAS Name: 6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-4,7-dimethyl-1-benzopyran-2-one IUPAC Name: 6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethoxy]-4,7-dimethylchromen-2-one Traditional Name: 6-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-keto-ethoxy]-4,7-dimethyl-coumarin Formula: C22H21NO4 MolecularWeight: 363.40644

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=CC(=C(C=C12)OCC(=O)N3CCC4=CC=CC=C4C3)C

Isomeric SMILES

CC1=CC(=O)OC2=CC(=C(C=C12)OCC(=O)N3CCC4=CC=CC=C4C3)C

InChI

InChI=1S/C22H21NO4/c1-14-10-22(25)27-20-9-15(2)19(11-18(14)20)26-13-21(24)23-8-7-16-5-3-4-6-17(16)12-23/h3-6,9-11H,7-8,12-13H2,1-2H3