2-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]methylamino]ethanoic acid

Systemtic Name: 2-[[4-(2-azanyl-2-oxidanylidene-ethoxy)-3-chloranyl-5-methoxy-phenyl]methylamino]ethanoic acid Openeye Name: 2-[[4-(2-amino-2-oxo-ethoxy)-3-chloro-5-methoxy-phenyl]methylamino]acetic acid CAS Name: 2-[[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]methylamino]acetic acid IUPAC Name: 2-[[4-(2-amino-2-oxoethoxy)-3-chloro-5-methoxyphenyl]methylamino]acetic acid Traditional Name: 2-[[4-(2-amino-2-keto-ethoxy)-3-chloro-5-methoxy-benzyl]amino]acetic acid Formula: C12H15ClN2O5 MolecularWeight: 302.7109

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=CC(=C1)CNCC(=O)O)Cl)OCC(=O)N

Isomeric SMILES

COC1=C(C(=CC(=C1)CNCC(=O)O)Cl)OCC(=O)N

InChI

InChI=1S/C12H15ClN2O5/c1-19-9-3-7(4-15-5-11(17)18)2-8(13)12(9)20-6-10(14)16/h2-3,15H,4-6H2,1H3,(H2,14,16)(H,17,18)