[(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(4-butylphenyl)ethanoate

Systemtic Name: [(1R)-2-(cyclopropylamino)-2-oxidanylidene-1-phenyl-ethyl] 2-(4-butylphenyl)ethanoate Openeye Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenyl-ethyl] 2-(4-butylphenyl)acetate CAS Name: 2-(4-butylphenyl)acetic acid [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] ester IUPAC Name: [(1R)-2-(cyclopropylamino)-2-oxo-1-phenylethyl] 2-(4-butylphenyl)acetate Traditional Name: 2-(4-butylphenyl)acetic acid [(1R)-2-(cyclopropylamino)-2-keto-1-phenyl-ethyl] ester Formula: C23H27NO3 MolecularWeight: 365.46538

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)CC(=O)OC(C2=CC=CC=C2)C(=O)NC3CC3

Isomeric SMILES

CCCCC1=CC=C(C=C1)CC(=O)O[C@H](C2=CC=CC=C2)C(=O)NC3CC3

InChI

InChI=1S/C23H27NO3/c1-2-3-7-17-10-12-18(13-11-17)16-21(25)27-22(19-8-5-4-6-9-19)23(26)24-20-14-15-20/h4-6,8-13,20,22H,2-3,7,14-16H2,1H3,(H,24,26)/t22-/m1/s1