4-[2-(3-chloranyl-4,5-dimethoxy-phenyl)ethylamino]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[2-(3-chloranyl-4,5-dimethoxy-phenyl)ethylamino]-4-oxidanylidene-butanoic acid Openeye Name: 4-[2-(3-chloro-4,5-dimethoxy-phenyl)ethylamino]-4-oxo-butanoic acid CAS Name: 4-[2-(3-chloro-4,5-dimethoxyphenyl)ethylamino]-4-oxobutanoic acid IUPAC Name: 4-[2-(3-chloro-4,5-dimethoxyphenyl)ethylamino]-4-oxobutanoic acid Traditional Name: 4-[2-(3-chloro-4,5-dimethoxy-phenyl)ethylamino]-4-keto-butyric acid Formula: C14H18ClNO5 MolecularWeight: 315.74942

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CCNC(=O)CCC(=O)O)Cl)OC

Isomeric SMILES

COC1=C(C(=CC(=C1)CCNC(=O)CCC(=O)O)Cl)OC

InChI

InChI=1S/C14H18ClNO5/c1-20-11-8-9(7-10(15)14(11)21-2)5-6-16-12(17)3-4-13(18)19/h7-8H,3-6H2,1-2H3,(H,16,17)(H,18,19)