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

Systemtic Name: 3-[[3-oxidanyl-5-(5-phenylpentan-2-yl)phenyl]amino]propanoic acid Openeye Name: 3-[3-hydroxy-5-(1-methyl-4-phenyl-butyl)anilino]propanoic acid CAS Name: 3-[3-hydroxy-5-(5-phenylpentan-2-yl)anilino]propanoic acid IUPAC Name: 3-[3-hydroxy-5-(5-phenylpentan-2-yl)anilino]propanoic acid Traditional Name: 3-[3-hydroxy-5-(1-methyl-4-phenyl-butyl)anilino]propionic acid Formula: C20H25NO3 MolecularWeight: 327.4174

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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)