3-[(7-methoxy-1-methyl-6-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-4-phenyl-isochromen-1-one

Systemtic Name: 3-[(7-methoxy-1-methyl-6-oxidanyl-3,4-dihydro-1H-isoquinolin-2-yl)carbonyl]-4-phenyl-isochromen-1-one Openeye Name: 3-(6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-phenyl-isochromen-1-one CAS Name: 3-[(6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinolin-2-yl)-oxomethyl]-4-phenyl-2-benzopyran-1-one IUPAC Name: 3-(6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-phenylisochromen-1-one Traditional Name: 3-(6-hydroxy-7-methoxy-1-methyl-3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-phenyl-isocoumarin Formula: C27H23NO5 MolecularWeight: 441.47522

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Descriptors Computed from Structure

Canonical SMILES:

CC1C2=CC(=C(C=C2CCN1C(=O)C3=C(C4=CC=CC=C4C(=O)O3)C5=CC=CC=C5)O)OC

Isomeric SMILES

CC1C2=CC(=C(C=C2CCN1C(=O)C3=C(C4=CC=CC=C4C(=O)O3)C5=CC=CC=C5)O)OC

InChI

InChI=1S/C27H23NO5/c1-16-21-15-23(32-2)22(29)14-18(21)12-13-28(16)26(30)25-24(17-8-4-3-5-9-17)19-10-6-7-11-20(19)27(31)33-25/h3-11,14-16,29H,12-13H2,1-2H3