(2S)-3-methyl-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2S)-3-methyl-N-[(2S)-2-methyl-3-oxidanylidene-4H-1,4-benzoxazin-6-yl]-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2S)-3-methyl-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-[(2-phenoxyacetyl)amino]butanamide CAS Name: (2S)-3-methyl-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: (2S)-3-methyl-N-[(2S)-2-methyl-3-oxo-4H-1,4-benzoxazin-6-yl]-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2S)-N-[(2S)-3-keto-2-methyl-4H-1,4-benzoxazin-6-yl]-3-methyl-2-[(2-phenoxyacetyl)amino]butyramide Formula: C22H25N3O5 MolecularWeight: 411.451

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)C(C(C)C)NC(=O)COC3=CC=CC=C3

Isomeric SMILES

C[C@H]1C(=O)NC2=C(O1)C=CC(=C2)NC(=O)[C@H](C(C)C)NC(=O)COC3=CC=CC=C3

InChI

InChI=1S/C22H25N3O5/c1-13(2)20(25-19(26)12-29-16-7-5-4-6-8-16)22(28)23-15-9-10-18-17(11-15)24-21(27)14(3)30-18/h4-11,13-14,20H,12H2,1-3H3,(H,23,28)(H,24,27)(H,25,26)/t14-,20-/m0/s1