4-[(7-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzoic acid

Systemtic Name: 4-[(7-methyl-3-oxidanylidene-1,4-benzoxazin-4-yl)methyl]benzoic acid Openeye Name: 4-[(7-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoic acid CAS Name: 4-[(7-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoic acid IUPAC Name: 4-[(7-methyl-3-oxo-1,4-benzoxazin-4-yl)methyl]benzoic acid Traditional Name: 4-[(3-keto-7-methyl-1,4-benzoxazin-4-yl)methyl]benzoic acid Formula: C17H15NO4 MolecularWeight: 297.3053

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=CC=C(C=C3)C(=O)O

Isomeric SMILES

CC1=CC2=C(C=C1)N(C(=O)CO2)CC3=CC=C(C=C3)C(=O)O

InChI

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