2-[4-(3-azanyl-3-oxidanylidene-propyl)-2-methoxy-phenoxy]ethanoic acid

Systemtic Name: 2-[4-(3-azanyl-3-oxidanylidene-propyl)-2-methoxy-phenoxy]ethanoic acid Openeye Name: 2-[4-(3-amino-3-oxo-propyl)-2-methoxy-phenoxy]acetic acid CAS Name: 2-[4-(3-amino-3-oxopropyl)-2-methoxyphenoxy]acetic acid IUPAC Name: 2-[4-(3-amino-3-oxopropyl)-2-methoxyphenoxy]acetic acid Traditional Name: 2-[4-(3-amino-3-keto-propyl)-2-methoxy-phenoxy]acetic acid Formula: C12H15NO5 MolecularWeight: 253.2512

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)CCC(=O)N)OCC(=O)O

Isomeric SMILES

COC1=C(C=CC(=C1)CCC(=O)N)OCC(=O)O

InChI

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