4-[[(2R)-4-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoate

Systemtic Name: 4-[[(2R)-4-(2-azanyl-2-oxidanylidene-ethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoate Openeye Name: 4-[[(2R)-4-(2-amino-2-oxo-ethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxo-butanoate CAS Name: 4-[[(2R)-4-(2-amino-2-oxoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoate IUPAC Name: 4-[[(2R)-4-(2-amino-2-oxoethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoate Traditional Name: 4-[[(2R)-4-(2-amino-2-keto-ethyl)-3-keto-2-methyl-1,4-benzoxazin-6-yl]amino]-4-keto-butyrate Formula: C15H16N3O6- MolecularWeight: 334.30404

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)CCC(=O)[O-])CC(=O)N

Isomeric SMILES

C[C@@H]1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)CCC(=O)[O-])CC(=O)N

InChI

InChI=1S/C15H17N3O6/c1-8-15(23)18(7-12(16)19)10-6-9(2-3-11(10)24-8)17-13(20)4-5-14(21)22/h2-3,6,8H,4-5,7H2,1H3,(H2,16,19)(H,17,20)(H,21,22)/p-1/t8-/m1/s1