7-[bis(2-methoxyethyl)amino]-3-phenyl-2H-isoquinolin-1-one

Systemtic Name: 7-[bis(2-methoxyethyl)amino]-3-phenyl-2H-isoquinolin-1-one Openeye Name: 7-[bis(2-methoxyethyl)amino]-3-phenyl-2H-isoquinolin-1-one CAS Name: 7-[bis(2-methoxyethyl)amino]-3-phenyl-2H-isoquinolin-1-one IUPAC Name: 7-[bis(2-methoxyethyl)amino]-3-phenyl-2H-isoquinolin-1-one Traditional Name: 7-[bis(2-methoxyethyl)amino]-3-phenyl-isocarbostyril Formula: C21H24N2O3 MolecularWeight: 352.42686

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COCCN(CCOC)C1=CC2=C(C=C1)C=C(NC2=O)C3=CC=CC=C3

Isomeric SMILES

COCCN(CCOC)C1=CC2=C(C=C1)C=C(NC2=O)C3=CC=CC=C3

InChI

InChI=1S/C21H24N2O3/c1-25-12-10-23(11-13-26-2)18-9-8-17-14-20(16-6-4-3-5-7-16)22-21(24)19(17)15-18/h3-9,14-15H,10-13H2,1-2H3,(H,22,24)