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

Systemtic Name: methyl 3-[[3-oxidanyl-5-(5-phenylpentan-2-yl)phenyl]amino]propanoate Openeye Name: methyl 3-[3-hydroxy-5-(1-methyl-4-phenyl-butyl)anilino]propanoate CAS Name: 3-[3-hydroxy-5-(5-phenylpentan-2-yl)anilino]propanoic acid methyl ester IUPAC Name: methyl 3-[3-hydroxy-5-(5-phenylpentan-2-yl)anilino]propanoate Traditional Name: 3-[3-hydroxy-5-(1-methyl-4-phenyl-butyl)anilino]propionic acid methyl ester Formula: C21H27NO3 MolecularWeight: 341.44398

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=CC=C1)C2=CC(=CC(=C2)O)NCCC(=O)OC

Isomeric SMILES

CC(CCCC1=CC=CC=C1)C2=CC(=CC(=C2)O)NCCC(=O)OC

InChI

InChI=1S/C21H27NO3/c1-16(7-6-10-17-8-4-3-5-9-17)18-13-19(15-20(23)14-18)22-12-11-21(24)25-2/h3-5,8-9,13-16,22-23H,6-7,10-12H2,1-2H3