(2S)-2-[(4-oxidanylidene-3,1-benzoxazin-2-yl)amino]-N-propan-2-yl-pentanediamide

Systemtic Name: (2S)-2-[(4-oxidanylidene-3,1-benzoxazin-2-yl)amino]-N-propan-2-yl-pentanediamide Openeye Name: (2S)-N-isopropyl-2-[(4-oxo-3,1-benzoxazin-2-yl)amino]pentanediamide CAS Name: (2S)-2-[(4-oxo-3,1-benzoxazin-2-yl)amino]-N-propan-2-ylpentanediamide IUPAC Name: (2S)-2-[(4-oxo-3,1-benzoxazin-2-yl)amino]-N-propan-2-ylpentanediamide Traditional Name: (2S)-N-isopropyl-2-[(4-keto-3,1-benzoxazin-2-yl)amino]glutaramide Formula: C16H20N4O4 MolecularWeight: 332.3544

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C(CCC(=O)N)NC1=NC2=CC=CC=C2C(=O)O1

Isomeric SMILES

CC(C)NC(=O)[C@H](CCC(=O)N)NC1=NC2=CC=CC=C2C(=O)O1

InChI

InChI=1S/C16H20N4O4/c1-9(2)18-14(22)12(7-8-13(17)21)20-16-19-11-6-4-3-5-10(11)15(23)24-16/h3-6,9,12H,7-8H2,1-2H3,(H2,17,21)(H,18,22)(H,19,20)/t12-/m0/s1