3-[(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzoic acid

Systemtic Name: 3-[(2-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzoic acid Openeye Name: 3-[(2-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoic acid CAS Name: 3-[(2-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoic acid IUPAC Name: 3-[(2-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoic acid Traditional Name: 3-[(3-keto-2-methyl-1,4-benzoxazin-4-yl)methyl]benzoic acid Formula: C17H15NO4 MolecularWeight: 297.3053

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Descriptors Computed from Structure

Canonical SMILES:

CC1C(=O)N(C2=CC=CC=C2O1)CC3=CC=CC(=C3)C(=O)O

Isomeric SMILES

CC1C(=O)N(C2=CC=CC=C2O1)CC3=CC=CC(=C3)C(=O)O

InChI

InChI=1S/C17H15NO4/c1-11-16(19)18(14-7-2-3-8-15(14)22-11)10-12-5-4-6-13(9-12)17(20)21/h2-9,11H,10H2,1H3,(H,20,21)