2-(3-azanylpropylcarbamoyl)benzoic acid

Systemtic Name: 2-(3-azanylpropylcarbamoyl)benzoic acid Openeye Name: 2-(3-aminopropylcarbamoyl)benzoic acid CAS Name: 2-[(3-aminopropylamino)-oxomethyl]benzoic acid IUPAC Name: 2-(3-aminopropylcarbamoyl)benzoic acid Traditional Name: 2-(3-aminopropylcarbamoyl)benzoic acid Formula: C11H14N2O3 MolecularWeight: 222.24046

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCCN)C(=O)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCCN)C(=O)O

InChI

InChI=1S/C11H14N2O3/c12-6-3-7-13-10(14)8-4-1-2-5-9(8)11(15)16/h1-2,4-5H,3,6-7,12H2,(H,13,14)(H,15,16)