4-[(2-oxidanylnaphthalen-1-yl)methylamino]benzoic acid

Systemtic Name: 4-[(2-oxidanylnaphthalen-1-yl)methylamino]benzoic acid Openeye Name: 4-[(2-hydroxy-1-naphthyl)methylamino]benzoic acid CAS Name: 4-[(2-hydroxy-1-naphthalenyl)methylamino]benzoic acid IUPAC Name: 4-[(2-hydroxynaphthalen-1-yl)methylamino]benzoic acid Traditional Name: 4-[(2-hydroxy-1-naphthyl)methylamino]benzoic acid Formula: C18H15NO3 MolecularWeight: 293.3166

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C=CC(=C2CNC3=CC=C(C=C3)C(=O)O)O

Isomeric SMILES

C1=CC=C2C(=C1)C=CC(=C2CNC3=CC=C(C=C3)C(=O)O)O

InChI

InChI=1S/C18H15NO3/c20-17-10-7-12-3-1-2-4-15(12)16(17)11-19-14-8-5-13(6-9-14)18(21)22/h1-10,19-20H,11H2,(H,21,22)