2-[4-azanyl-2-(3-methoxypropyl)phenoxy]ethanoic acid

Systemtic Name: 2-[4-azanyl-2-(3-methoxypropyl)phenoxy]ethanoic acid Openeye Name: 2-[4-amino-2-(3-methoxypropyl)phenoxy]acetic acid CAS Name: 2-[4-amino-2-(3-methoxypropyl)phenoxy]acetic acid IUPAC Name: 2-[4-amino-2-(3-methoxypropyl)phenoxy]acetic acid Traditional Name: 2-[4-amino-2-(3-methoxypropyl)phenoxy]acetic acid Formula: C12H17NO4 MolecularWeight: 239.26768

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Descriptors Computed from Structure

Canonical SMILES:

COCCCC1=C(C=CC(=C1)N)OCC(=O)O

Isomeric SMILES

COCCCC1=C(C=CC(=C1)N)OCC(=O)O

InChI

InChI=1S/C12H17NO4/c1-16-6-2-3-9-7-10(13)4-5-11(9)17-8-12(14)15/h4-5,7H,2-3,6,8,13H2,1H3,(H,14,15)