3-(3,3,7-trimethyl-4H-isoquinolin-1-yl)chromen-2-one

Systemtic Name: 3-(3,3,7-trimethyl-4H-isoquinolin-1-yl)chromen-2-one Openeye Name: 3-(3,3,7-trimethyl-4H-isoquinolin-1-yl)chromen-2-one CAS Name: 3-(3,3,7-trimethyl-4H-isoquinolin-1-yl)-1-benzopyran-2-one IUPAC Name: 3-(3,3,7-trimethyl-4H-isoquinolin-1-yl)chromen-2-one Traditional Name: 3-(3,3,7-trimethyl-4H-isoquinolin-1-yl)coumarin Formula: C21H19NO2 MolecularWeight: 317.38106

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(CC(N=C2C3=CC4=CC=CC=C4OC3=O)(C)C)C=C1

Isomeric SMILES

CC1=CC2=C(CC(N=C2C3=CC4=CC=CC=C4OC3=O)(C)C)C=C1

InChI

InChI=1S/C21H19NO2/c1-13-8-9-15-12-21(2,3)22-19(16(15)10-13)17-11-14-6-4-5-7-18(14)24-20(17)23/h4-11H,12H2,1-3H3