5-azanyl-2-[2-(2-methylpropylamino)-2-oxidanylidene-ethoxy]benzoic acid

Systemtic Name: 5-azanyl-2-[2-(2-methylpropylamino)-2-oxidanylidene-ethoxy]benzoic acid Openeye Name: 5-amino-2-[2-(isobutylamino)-2-oxo-ethoxy]benzoic acid CAS Name: 5-amino-2-[2-(2-methylpropylamino)-2-oxoethoxy]benzoic acid IUPAC Name: 5-amino-2-[2-(2-methylpropylamino)-2-oxoethoxy]benzoic acid Traditional Name: 5-amino-2-[2-(isobutylamino)-2-keto-ethoxy]benzoic acid Formula: C13H18N2O4 MolecularWeight: 266.29302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CNC(=O)COC1=C(C=C(C=C1)N)C(=O)O

Isomeric SMILES

CC(C)CNC(=O)COC1=C(C=C(C=C1)N)C(=O)O

InChI

InChI=1S/C13H18N2O4/c1-8(2)6-15-12(16)7-19-11-4-3-9(14)5-10(11)13(17)18/h3-5,8H,6-7,14H2,1-2H3,(H,15,16)(H,17,18)