(phenylmethyl) N-[(2S)-4-azanyl-1,4-bis(oxidanylidene)-1-[(4-oxidanylidene-7-propan-2-yl-3,1-benzoxazin-2-yl)amino]butan-2-yl]carbamate

Systemtic Name: (phenylmethyl) N-[(2S)-4-azanyl-1,4-bis(oxidanylidene)-1-[(4-oxidanylidene-7-propan-2-yl-3,1-benzoxazin-2-yl)amino]butan-2-yl]carbamate Openeye Name: benzyl N-[(1S)-3-amino-1-[(7-isopropyl-4-oxo-3,1-benzoxazin-2-yl)carbamoyl]-3-oxo-propyl]carbamate CAS Name: N-[(2S)-4-amino-1,4-dioxo-1-[(4-oxo-7-propan-2-yl-3,1-benzoxazin-2-yl)amino]butan-2-yl]carbamic acid (phenylmethyl) ester IUPAC Name: benzyl N-[(2S)-4-amino-1,4-dioxo-1-[(4-oxo-7-propan-2-yl-3,1-benzoxazin-2-yl)amino]butan-2-yl]carbamate Traditional Name: N-[(1S)-3-amino-1-[(7-isopropyl-4-keto-3,1-benzoxazin-2-yl)carbamoyl]-3-keto-propyl]carbamic acid benzyl ester Formula: C23H24N4O6 MolecularWeight: 452.45986

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CC2=C(C=C1)C(=O)OC(=N2)NC(=O)C(CC(=O)N)NC(=O)OCC3=CC=CC=C3

Isomeric SMILES

CC(C)C1=CC2=C(C=C1)C(=O)OC(=N2)NC(=O)[C@H](CC(=O)N)NC(=O)OCC3=CC=CC=C3

InChI

InChI=1S/C23H24N4O6/c1-13(2)15-8-9-16-17(10-15)25-22(33-21(16)30)27-20(29)18(11-19(24)28)26-23(31)32-12-14-6-4-3-5-7-14/h3-10,13,18H,11-12H2,1-2H3,(H2,24,28)(H,26,31)(H,25,27,29)/t18-/m0/s1