4-(3-azanyl-2-methyl-3-oxidanylidene-propoxy)-3-ethoxy-benzoic acid

Systemtic Name: 4-(3-azanyl-2-methyl-3-oxidanylidene-propoxy)-3-ethoxy-benzoic acid Openeye Name: 4-(3-amino-2-methyl-3-oxo-propoxy)-3-ethoxy-benzoic acid CAS Name: 4-(3-amino-2-methyl-3-oxopropoxy)-3-ethoxybenzoic acid IUPAC Name: 4-(3-amino-2-methyl-3-oxopropoxy)-3-ethoxybenzoic acid Traditional Name: 4-(3-amino-3-keto-2-methyl-propoxy)-3-ethoxy-benzoic acid Formula: C13H17NO5 MolecularWeight: 267.27778

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=CC(=C1)C(=O)O)OCC(C)C(=O)N

Isomeric SMILES

CCOC1=C(C=CC(=C1)C(=O)O)OCC(C)C(=O)N

InChI

InChI=1S/C13H17NO5/c1-3-18-11-6-9(13(16)17)4-5-10(11)19-7-8(2)12(14)15/h4-6,8H,3,7H2,1-2H3,(H2,14,15)(H,16,17)