3-[[azanyl(phenyl)amino]methyl]-1-benzofuran-2-carboxylic acid

Systemtic Name: 3-[[azanyl(phenyl)amino]methyl]-1-benzofuran-2-carboxylic acid Openeye Name: 3-[(N-aminoanilino)methyl]benzofuran-2-carboxylic acid CAS Name: 3-[(N-aminoanilino)methyl]-2-benzofurancarboxylic acid IUPAC Name: 3-[(N-aminoanilino)methyl]-1-benzofuran-2-carboxylic acid Traditional Name: 3-[(N-aminoanilino)methyl]coumarilic acid Formula: C16H14N2O3 MolecularWeight: 282.29396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)N(CC2=C(OC3=CC=CC=C32)C(=O)O)N

Isomeric SMILES

C1=CC=C(C=C1)N(CC2=C(OC3=CC=CC=C32)C(=O)O)N

InChI

InChI=1S/C16H14N2O3/c17-18(11-6-2-1-3-7-11)10-13-12-8-4-5-9-14(12)21-15(13)16(19)20/h1-9H,10,17H2,(H,19,20)