4-[4-(aminomethyl)-2-methoxy-phenoxy]-4-oxidanylidene-butanoic acid

Systemtic Name: 4-[4-(aminomethyl)-2-methoxy-phenoxy]-4-oxidanylidene-butanoic acid Openeye Name: 4-[4-(aminomethyl)-2-methoxy-phenoxy]-4-oxo-butanoic acid CAS Name: 4-[4-(aminomethyl)-2-methoxyphenoxy]-4-oxobutanoic acid IUPAC Name: 4-[4-(aminomethyl)-2-methoxyphenoxy]-4-oxobutanoic acid Traditional Name: 4-[4-(aminomethyl)-2-methoxy-phenoxy]-4-keto-butyric acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CN)OC(=O)CCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CN)OC(=O)CCC(=O)O

InChI

InChI=1S/C12H15NO5/c1-17-10-6-8(7-13)2-3-9(10)18-12(16)5-4-11(14)15/h2-3,6H,4-5,7,13H2,1H3,(H,14,15)