4-[[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]amino]butanoic acid

Systemtic Name: 4-[[2-[(3-chloranyl-4-methoxy-phenyl)amino]-2-oxidanylidene-ethyl]amino]butanoic acid Openeye Name: 4-[[2-(3-chloro-4-methoxy-anilino)-2-oxo-ethyl]amino]butanoic acid CAS Name: 4-[[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]amino]butanoic acid IUPAC Name: 4-[[2-(3-chloro-4-methoxyanilino)-2-oxoethyl]amino]butanoic acid Traditional Name: 4-[[2-(3-chloro-4-methoxy-anilino)-2-keto-ethyl]amino]butyric acid Formula: C13H17ClN2O4 MolecularWeight: 300.73808

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CNCCCC(=O)O)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CNCCCC(=O)O)Cl

InChI

InChI=1S/C13H17ClN2O4/c1-20-11-5-4-9(7-10(11)14)16-12(17)8-15-6-2-3-13(18)19/h4-5,7,15H,2-3,6,8H2,1H3,(H,16,17)(H,18,19)