methyl 3-(3-azanylpropanoylamino)-4-chloranyl-benzoate

Systemtic Name: methyl 3-(3-azanylpropanoylamino)-4-chloranyl-benzoate Openeye Name: methyl 3-(3-aminopropanoylamino)-4-chloro-benzoate CAS Name: 3-[(3-amino-1-oxopropyl)amino]-4-chlorobenzoic acid methyl ester IUPAC Name: methyl 3-(3-aminopropanoylamino)-4-chlorobenzoate Traditional Name: 3-(3-aminopropanoylamino)-4-chloro-benzoic acid methyl ester Formula: C11H13ClN2O3 MolecularWeight: 256.68552

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CCN

Isomeric SMILES

COC(=O)C1=CC(=C(C=C1)Cl)NC(=O)CCN

InChI

InChI=1S/C11H13ClN2O3/c1-17-11(16)7-2-3-8(12)9(6-7)14-10(15)4-5-13/h2-3,6H,4-5,13H2,1H3,(H,14,15)