3-[(4-methoxyphenyl)-propyl-amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[(4-methoxyphenyl)-propyl-amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-(4-methoxy-N-propyl-anilino)-3-oxo-propanoic acid CAS Name: 3-(4-methoxy-N-propylanilino)-3-oxopropanoic acid IUPAC Name: 3-(4-methoxy-N-propylanilino)-3-oxopropanoic acid Traditional Name: 3-keto-3-(4-methoxy-N-propyl-anilino)propionic acid Formula: C13H17NO4 MolecularWeight: 251.27838

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCN(C1=CC=C(C=C1)OC)C(=O)CC(=O)O

Isomeric SMILES

CCCN(C1=CC=C(C=C1)OC)C(=O)CC(=O)O

InChI

InChI=1S/C13H17NO4/c1-3-8-14(12(15)9-13(16)17)10-4-6-11(18-2)7-5-10/h4-7H,3,8-9H2,1-2H3,(H,16,17)