6-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2,2-dimethyl-4-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one

Systemtic Name: 6-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)-2,2-dimethyl-4-[2-(4-methylphenyl)-2-oxidanylidene-ethyl]-1,4-benzoxazin-3-one Openeye Name: 6-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2,2-dimethyl-4-[2-oxo-2-(p-tolyl)ethyl]-1,4-benzoxazin-3-one CAS Name: 6-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]-2,2-dimethyl-4-[2-(4-methylphenyl)-2-oxoethyl]-1,4-benzoxazin-3-one IUPAC Name: 6-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-2,2-dimethyl-4-[2-(4-methylphenyl)-2-oxoethyl]-1,4-benzoxazin-3-one Traditional Name: 6-(3,4-dihydro-1H-isoquinoline-2-carbonyl)-4-[2-keto-2-(p-tolyl)ethyl]-2,2-dimethyl-1,4-benzoxazin-3-one Formula: C29H28N2O4 MolecularWeight: 468.54362

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)CN2C3=C(C=CC(=C3)C(=O)N4CCC5=CC=CC=C5C4)OC(C2=O)(C)C

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)CN2C3=C(C=CC(=C3)C(=O)N4CCC5=CC=CC=C5C4)OC(C2=O)(C)C

InChI

InChI=1S/C29H28N2O4/c1-19-8-10-21(11-9-19)25(32)18-31-24-16-22(12-13-26(24)35-29(2,3)28(31)34)27(33)30-15-14-20-6-4-5-7-23(20)17-30/h4-13,16H,14-15,17-18H2,1-3H3