N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-butan-2-yl]-2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide

Systemtic Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethyl-butan-2-yl]-2-(3-oxidanylidene-1,4-benzoxazin-4-yl)ethanamide Openeye Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2,2-dimethyl-propyl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide CAS Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethylbutan-2-yl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide IUPAC Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-yl)-3,3-dimethylbutan-2-yl]-2-(3-oxo-1,4-benzoxazin-4-yl)acetamide Traditional Name: N-[1-(3,4-dihydro-1H-isoquinolin-2-ylmethyl)-2,2-dimethyl-propyl]-2-(3-keto-1,4-benzoxazin-4-yl)acetamide Formula: C25H31N3O3 MolecularWeight: 421.53194

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(CN1CCC2=CC=CC=C2C1)NC(=O)CN3C(=O)COC4=CC=CC=C43

Isomeric SMILES

CC(C)(C)C(CN1CCC2=CC=CC=C2C1)NC(=O)CN3C(=O)COC4=CC=CC=C43

InChI

InChI=1S/C25H31N3O3/c1-25(2,3)22(15-27-13-12-18-8-4-5-9-19(18)14-27)26-23(29)16-28-20-10-6-7-11-21(20)31-17-24(28)30/h4-11,22H,12-17H2,1-3H3,(H,26,29)