5-(3-azanylpropanoylamino)-2-chloranyl-benzoic acid

Systemtic Name: 5-(3-azanylpropanoylamino)-2-chloranyl-benzoic acid Openeye Name: 5-(3-aminopropanoylamino)-2-chloro-benzoic acid CAS Name: 5-[(3-amino-1-oxopropyl)amino]-2-chlorobenzoic acid IUPAC Name: 5-(3-aminopropanoylamino)-2-chlorobenzoic acid Traditional Name: 5-(3-aminopropanoylamino)-2-chloro-benzoic acid Formula: C10H11ClN2O3 MolecularWeight: 242.65894

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=C(C=C1NC(=O)CCN)C(=O)O)Cl

Isomeric SMILES

C1=CC(=C(C=C1NC(=O)CCN)C(=O)O)Cl

InChI

InChI=1S/C10H11ClN2O3/c11-8-2-1-6(5-7(8)10(15)16)13-9(14)3-4-12/h1-2,5H,3-4,12H2,(H,13,14)(H,15,16)