(2S)-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-1-(4-oxidanylidene-3,1-benzoxazin-2-yl)pyrrolidine-2-carboxamide

Systemtic Name: (2S)-N-[(2S)-1-azanyl-1-oxidanylidene-3-phenyl-propan-2-yl]-1-(4-oxidanylidene-3,1-benzoxazin-2-yl)pyrrolidine-2-carboxamide Openeye Name: (2S)-N-[(1S)-2-amino-1-benzyl-2-oxo-ethyl]-1-(4-oxo-3,1-benzoxazin-2-yl)pyrrolidine-2-carboxamide CAS Name: (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-1-(4-oxo-3,1-benzoxazin-2-yl)-2-pyrrolidinecarboxamide IUPAC Name: (2S)-N-[(2S)-1-amino-1-oxo-3-phenylpropan-2-yl]-1-(4-oxo-3,1-benzoxazin-2-yl)pyrrolidine-2-carboxamide Traditional Name: (2S)-N-[(1S)-2-amino-1-benzyl-2-keto-ethyl]-1-(4-keto-3,1-benzoxazin-2-yl)pyrrolidine-2-carboxamide Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(N(C1)C2=NC3=CC=CC=C3C(=O)O2)C(=O)NC(CC4=CC=CC=C4)C(=O)N

Isomeric SMILES

C1C[C@H](N(C1)C2=NC3=CC=CC=C3C(=O)O2)C(=O)N[C@@H](CC4=CC=CC=C4)C(=O)N

InChI

InChI=1S/C22H22N4O4/c23-19(27)17(13-14-7-2-1-3-8-14)24-20(28)18-11-6-12-26(18)22-25-16-10-5-4-9-15(16)21(29)30-22/h1-5,7-10,17-18H,6,11-13H2,(H2,23,27)(H,24,28)/t17-,18-/m0/s1