3-azanyl-3-(4-butoxy-3-methoxy-phenyl)propanoic acid

Systemtic Name: 3-azanyl-3-(4-butoxy-3-methoxy-phenyl)propanoic acid Openeye Name: 3-amino-3-(4-butoxy-3-methoxy-phenyl)propanoic acid CAS Name: 3-amino-3-(4-butoxy-3-methoxyphenyl)propanoic acid IUPAC Name: 3-amino-3-(4-butoxy-3-methoxyphenyl)propanoic acid Traditional Name: 3-amino-3-(4-butoxy-3-methoxy-phenyl)propionic acid Formula: C14H21NO4 MolecularWeight: 267.32084

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC1=C(C=C(C=C1)C(CC(=O)O)N)OC

Isomeric SMILES

CCCCOC1=C(C=C(C=C1)C(CC(=O)O)N)OC

InChI

InChI=1S/C14H21NO4/c1-3-4-7-19-12-6-5-10(8-13(12)18-2)11(15)9-14(16)17/h5-6,8,11H,3-4,7,9,15H2,1-2H3,(H,16,17)