4-azanyl-2-[[3,5-bis(chloranyl)-4-methoxy-phenyl]carbonylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-azanyl-2-[[3,5-bis(chloranyl)-4-methoxy-phenyl]carbonylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-amino-2-[(3,5-dichloro-4-methoxy-benzoyl)amino]-4-oxo-butanoic acid CAS Name: 4-amino-2-[[(3,5-dichloro-4-methoxyphenyl)-oxomethyl]amino]-4-oxobutanoic acid IUPAC Name: 4-amino-2-[(3,5-dichloro-4-methoxybenzoyl)amino]-4-oxobutanoic acid Traditional Name: 4-amino-2-[(3,5-dichloro-4-methoxy-benzoyl)amino]-4-keto-butyric acid Formula: C12H12Cl2N2O5 MolecularWeight: 335.14008

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1Cl)C(=O)NC(CC(=O)N)C(=O)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1Cl)C(=O)NC(CC(=O)N)C(=O)O)Cl

InChI

InChI=1S/C12H12Cl2N2O5/c1-21-10-6(13)2-5(3-7(10)14)11(18)16-8(12(19)20)4-9(15)17/h2-3,8H,4H2,1H3,(H2,15,17)(H,16,18)(H,19,20)