(2E)-3-(3-methylphenyl)-3-oxidanylidene-2-(2-oxidanylidene-4H-1,4-benzoxazin-3-ylidene)propanoic acid

Systemtic Name: (2E)-3-(3-methylphenyl)-3-oxidanylidene-2-(2-oxidanylidene-4H-1,4-benzoxazin-3-ylidene)propanoic acid Openeye Name: (2E)-3-(m-tolyl)-3-oxo-2-(2-oxo-4H-1,4-benzoxazin-3-ylidene)propanoic acid CAS Name: (2E)-3-(3-methylphenyl)-3-oxo-2-(2-oxo-4H-1,4-benzoxazin-3-ylidene)propanoic acid IUPAC Name: (2E)-3-(3-methylphenyl)-3-oxo-2-(2-oxo-4H-1,4-benzoxazin-3-ylidene)propanoic acid Traditional Name: (2E)-3-keto-2-(2-keto-4H-1,4-benzoxazin-3-ylidene)-3-(m-tolyl)propionic acid Formula: C18H13NO5 MolecularWeight: 323.29952

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)C(=C2C(=O)OC3=CC=CC=C3N2)C(=O)O

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)/C(=C\2/C(=O)OC3=CC=CC=C3N2)/C(=O)O

InChI

InChI=1S/C18H13NO5/c1-10-5-4-6-11(9-10)16(20)14(17(21)22)15-18(23)24-13-8-3-2-7-12(13)19-15/h2-9,19H,1H3,(H,21,22)/b15-14+