4-(2-azanylethylcarbamoyl)benzoic acid

Systemtic Name: 4-(2-azanylethylcarbamoyl)benzoic acid Openeye Name: 4-(2-aminoethylcarbamoyl)benzoic acid CAS Name: 4-[(2-aminoethylamino)-oxomethyl]benzoic acid IUPAC Name: 4-(2-aminoethylcarbamoyl)benzoic acid Traditional Name: 4-(2-aminoethylcarbamoyl)benzoic acid Formula: C10H12N2O3 MolecularWeight: 208.21388

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1C(=O)NCCN)C(=O)O

Isomeric SMILES

C1=CC(=CC=C1C(=O)NCCN)C(=O)O

InChI

InChI=1S/C10H12N2O3/c11-5-6-12-9(13)7-1-3-8(4-2-7)10(14)15/h1-4H,5-6,11H2,(H,12,13)(H,14,15)