2-[(4-methoxyphenyl)methyl]-4,4-dimethyl-7-nitro-3H-isoquinolin-1-one

Systemtic Name: 2-[(4-methoxyphenyl)methyl]-4,4-dimethyl-7-nitro-3H-isoquinolin-1-one Openeye Name: 2-[(4-methoxyphenyl)methyl]-4,4-dimethyl-7-nitro-3H-isoquinolin-1-one CAS Name: 2-[(4-methoxyphenyl)methyl]-4,4-dimethyl-7-nitro-3H-isoquinolin-1-one IUPAC Name: 2-[(4-methoxyphenyl)methyl]-4,4-dimethyl-7-nitro-3H-isoquinolin-1-one Traditional Name: 4,4-dimethyl-7-nitro-2-p-anisyl-3H-isoquinolin-1-one Formula: C19H20N2O4 MolecularWeight: 340.3731

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1(CN(C(=O)C2=C1C=CC(=C2)[N+](=O)[O-])CC3=CC=C(C=C3)OC)C

Isomeric SMILES

CC1(CN(C(=O)C2=C1C=CC(=C2)[N+](=O)[O-])CC3=CC=C(C=C3)OC)C

InChI

InChI=1S/C19H20N2O4/c1-19(2)12-20(11-13-4-7-15(25-3)8-5-13)18(22)16-10-14(21(23)24)6-9-17(16)19/h4-10H,11-12H2,1-3H3