1-[(4-acetamido-5-chloranyl-2-methoxy-phenyl)carbonylamino]-2-propanoyl-pyrrolidine-2-carboxylic acid

Systemtic Name: 1-[(4-acetamido-5-chloranyl-2-methoxy-phenyl)carbonylamino]-2-propanoyl-pyrrolidine-2-carboxylic acid Openeye Name: 1-[(4-acetamido-5-chloro-2-methoxy-benzoyl)amino]-2-propanoyl-pyrrolidine-2-carboxylic acid CAS Name: 1-[[(4-acetamido-5-chloro-2-methoxyphenyl)-oxomethyl]amino]-2-(1-oxopropyl)-2-pyrrolidinecarboxylic acid IUPAC Name: 1-[(4-acetamido-5-chloro-2-methoxybenzoyl)amino]-2-propanoylpyrrolidine-2-carboxylic acid Traditional Name: 1-[(4-acetamido-5-chloro-2-methoxy-benzoyl)amino]-2-propionyl-proline Formula: C18H22ClN3O6 MolecularWeight: 411.83678

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)C1(CCCN1NC(=O)C2=CC(=C(C=C2OC)NC(=O)C)Cl)C(=O)O

Isomeric SMILES

CCC(=O)C1(CCCN1NC(=O)C2=CC(=C(C=C2OC)NC(=O)C)Cl)C(=O)O

InChI

InChI=1S/C18H22ClN3O6/c1-4-15(24)18(17(26)27)6-5-7-22(18)21-16(25)11-8-12(19)13(20-10(2)23)9-14(11)28-3/h8-9H,4-7H2,1-3H3,(H,20,23)(H,21,25)(H,26,27)