2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]ethanamide

Systemtic Name: 2-[(1S)-2-ethanoyl-1H-isoquinolin-1-yl]-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]ethanamide Openeye Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]acetamide CAS Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]acetamide IUPAC Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]acetamide Traditional Name: 2-[(1S)-2-acetyl-1H-isoquinolin-1-yl]-N-[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]acetamide Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)CC3C4=CC=CC=C4C=CN3C(=O)C

Isomeric SMILES

C[C@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C[C@H]3C4=CC=CC=C4C=CN3C(=O)C

InChI

InChI=1S/C22H21N3O4/c1-13-22(28)24-18-11-16(7-8-20(18)29-13)23-21(27)12-19-17-6-4-3-5-15(17)9-10-25(19)14(2)26/h3-11,13,19H,12H2,1-2H3,(H,23,27)(H,24,28)/t13-,19-/m0/s1