4-[[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]methyl]-6-(2-methylbutan-2-yl)-1,4-benzoxazin-3-one

Systemtic Name: 4-[[3-(3,4-dihydro-1H-isoquinolin-2-ylcarbonyl)phenyl]methyl]-6-(2-methylbutan-2-yl)-1,4-benzoxazin-3-one Openeye Name: 4-[[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]methyl]-6-(1,1-dimethylpropyl)-1,4-benzoxazin-3-one CAS Name: 4-[[3-[3,4-dihydro-1H-isoquinolin-2-yl(oxo)methyl]phenyl]methyl]-6-(2-methylbutan-2-yl)-1,4-benzoxazin-3-one IUPAC Name: 4-[[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)phenyl]methyl]-6-(2-methylbutan-2-yl)-1,4-benzoxazin-3-one Traditional Name: 6-tert-amyl-4-[3-(3,4-dihydro-1H-isoquinoline-2-carbonyl)benzyl]-1,4-benzoxazin-3-one Formula: C30H32N2O3 MolecularWeight: 468.58668

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC(=C3)C(=O)N4CCC5=CC=CC=C5C4

Isomeric SMILES

CCC(C)(C)C1=CC2=C(C=C1)OCC(=O)N2CC3=CC=CC(=C3)C(=O)N4CCC5=CC=CC=C5C4

InChI

InChI=1S/C30H32N2O3/c1-4-30(2,3)25-12-13-27-26(17-25)32(28(33)20-35-27)18-21-8-7-11-23(16-21)29(34)31-15-14-22-9-5-6-10-24(22)19-31/h5-13,16-17H,4,14-15,18-20H2,1-3H3