4-[(3-aminophenyl)-oxidanyl-methyl]-2-methoxycarbonyl-benzoic acid

Systemtic Name: 4-[(3-aminophenyl)-oxidanyl-methyl]-2-methoxycarbonyl-benzoic acid Openeye Name: 4-[(3-aminophenyl)-hydroxy-methyl]-2-methoxycarbonyl-benzoic acid CAS Name: 4-[(3-aminophenyl)-hydroxymethyl]-2-methoxycarbonylbenzoic acid IUPAC Name: 4-[(3-aminophenyl)-hydroxymethyl]-2-methoxycarbonylbenzoic acid Traditional Name: 4-[(3-aminophenyl)-hydroxy-methyl]-2-carbomethoxy-benzoic acid Formula: C16H15NO5 MolecularWeight: 301.294

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C=CC(=C1)C(C2=CC(=CC=C2)N)O)C(=O)O

Isomeric SMILES

COC(=O)C1=C(C=CC(=C1)C(C2=CC(=CC=C2)N)O)C(=O)O

InChI

InChI=1S/C16H15NO5/c1-22-16(21)13-8-10(5-6-12(13)15(19)20)14(18)9-3-2-4-11(17)7-9/h2-8,14,18H,17H2,1H3,(H,19,20)