3-methylaniline; 3-oxidanyl-4-(phenylcarbonyl)benzoic acid

Systemtic Name: 3-methylaniline; 3-oxidanyl-4-(phenylcarbonyl)benzoic acid Openeye Name: 4-benzoyl-3-hydroxy-benzoic acid; 3-methylaniline CAS Name: 4-benzoyl-3-hydroxybenzoic acid; 3-methylaniline IUPAC Name: 4-benzoyl-3-hydroxybenzoic acid; 3-methylaniline Traditional Name: 4-benzoyl-3-hydroxy-benzoic acid; m-toluidine Formula: C21H19NO4 MolecularWeight: 349.37986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)N.C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)C(=O)O)O

Isomeric SMILES

CC1=CC(=CC=C1)N.C1=CC=C(C=C1)C(=O)C2=C(C=C(C=C2)C(=O)O)O

InChI

InChI=1S/C14H10O4.C7H9N/c15-12-8-10(14(17)18)6-7-11(12)13(16)9-4-2-1-3-5-9;1-6-3-2-4-7(8)5-6/h1-8,15H,(H,17,18);2-5H,8H2,1H3