3-[2-[(4-methoxyphenyl)methoxymethyl]phenyl]-7-methyl-2H-isoquinolin-1-one

Systemtic Name: 3-[2-[(4-methoxyphenyl)methoxymethyl]phenyl]-7-methyl-2H-isoquinolin-1-one Openeye Name: 3-[2-[(4-methoxyphenyl)methoxymethyl]phenyl]-7-methyl-2H-isoquinolin-1-one CAS Name: 3-[2-[(4-methoxyphenyl)methoxymethyl]phenyl]-7-methyl-2H-isoquinolin-1-one IUPAC Name: 3-[2-[(4-methoxyphenyl)methoxymethyl]phenyl]-7-methyl-2H-isoquinolin-1-one Traditional Name: 7-methyl-3-[2-(p-anisyloxymethyl)phenyl]isocarbostyril Formula: C25H23NO3 MolecularWeight: 385.45502

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)C=C(NC2=O)C3=CC=CC=C3COCC4=CC=C(C=C4)OC

Isomeric SMILES

CC1=CC2=C(C=C1)C=C(NC2=O)C3=CC=CC=C3COCC4=CC=C(C=C4)OC

InChI

InChI=1S/C25H23NO3/c1-17-7-10-19-14-24(26-25(27)23(19)13-17)22-6-4-3-5-20(22)16-29-15-18-8-11-21(28-2)12-9-18/h3-14H,15-16H2,1-2H3,(H,26,27)