3-[[3-oxidanyl-5-(5-phenylpentan-2-yl)phenyl]amino]propanoate

Systemtic Name: 3-[[3-oxidanyl-5-(5-phenylpentan-2-yl)phenyl]amino]propanoate Openeye Name: 3-[3-hydroxy-5-(1-methyl-4-phenyl-butyl)anilino]propanoate CAS Name: 3-[3-hydroxy-5-(5-phenylpentan-2-yl)anilino]propanoate IUPAC Name: 3-[3-hydroxy-5-(5-phenylpentan-2-yl)anilino]propanoate Traditional Name: 3-[3-hydroxy-5-(1-methyl-4-phenyl-butyl)anilino]propionate Formula: C20H24NO3- MolecularWeight: 326.40946

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1)C2=CC(=CC(=C2)O)NCCC(=O)[O-]

Isomeric SMILES

CC(CCCC1=CC=CC=C1)C2=CC(=CC(=C2)O)NCCC(=O)[O-]

InChI

InChI=1S/C20H25NO3/c1-15(6-5-9-16-7-3-2-4-8-16)17-12-18(14-19(22)13-17)21-11-10-20(23)24/h2-4,7-8,12-15,21-22H,5-6,9-11H2,1H3,(H,23,24)/p-1