2-[[6-(2-methoxyethanoylamino)-5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl]amino]propanoic acid

Systemtic Name: 2-[[6-(2-methoxyethanoylamino)-5-methyl-4-oxidanylidene-3,1-benzoxazin-2-yl]amino]propanoic acid Openeye Name: 2-[[6-[(2-methoxyacetyl)amino]-5-methyl-4-oxo-3,1-benzoxazin-2-yl]amino]propanoic acid CAS Name: 2-[[6-[(2-methoxy-1-oxoethyl)amino]-5-methyl-4-oxo-3,1-benzoxazin-2-yl]amino]propanoic acid IUPAC Name: 2-[[6-[(2-methoxyacetyl)amino]-5-methyl-4-oxo-3,1-benzoxazin-2-yl]amino]propanoic acid Traditional Name: 2-[[4-keto-6-[(2-methoxyacetyl)amino]-5-methyl-3,1-benzoxazin-2-yl]amino]propionic acid Formula: C15H17N3O6 MolecularWeight: 335.31198

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1C(=O)OC(=N2)NC(C)C(=O)O)NC(=O)COC

Isomeric SMILES

CC1=C(C=CC2=C1C(=O)OC(=N2)NC(C)C(=O)O)NC(=O)COC

InChI

InChI=1S/C15H17N3O6/c1-7-9(17-11(19)6-23-3)4-5-10-12(7)14(22)24-15(18-10)16-8(2)13(20)21/h4-5,8H,6H2,1-3H3,(H,16,18)(H,17,19)(H,20,21)