4-[[(2R)-4-(cyanomethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[[(2R)-4-(cyanomethyl)-2-methyl-3-oxidanylidene-1,4-benzoxazin-6-yl]amino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[[(2R)-4-(cyanomethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxo-butanoic acid CAS Name: 4-[[(2R)-4-(cyanomethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoic acid IUPAC Name: 4-[[(2R)-4-(cyanomethyl)-2-methyl-3-oxo-1,4-benzoxazin-6-yl]amino]-4-oxobutanoic acid Traditional Name: 4-[[(2R)-4-(cyanomethyl)-3-keto-2-methyl-1,4-benzoxazin-6-yl]amino]-4-keto-butyric acid Formula: C15H15N3O5 MolecularWeight: 317.2967

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=C(O1)C=CC(=C2)NC(=O)CCC(=O)O)CC#N

Isomeric SMILES

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

InChI

InChI=1S/C15H15N3O5/c1-9-15(22)18(7-6-16)11-8-10(2-3-12(11)23-9)17-13(19)4-5-14(20)21/h2-3,8-9H,4-5,7H2,1H3,(H,17,19)(H,20,21)/t9-/m1/s1