[(1R,2S)-1-[bis(phenylmethyl)amino]-5-oxidanylidene-1-phenyl-hexan-2-yl] ethanoate

Systemtic Name: [(1R,2S)-1-[bis(phenylmethyl)amino]-5-oxidanylidene-1-phenyl-hexan-2-yl] ethanoate Openeye Name: [(1S)-1-[(R)-(dibenzylamino)-phenyl-methyl]-4-oxo-pentyl] acetate CAS Name: acetic acid [(1R,2S)-1-[bis(phenylmethyl)amino]-5-oxo-1-phenylhexan-2-yl] ester IUPAC Name: [(1R,2S)-1-(dibenzylamino)-5-oxo-1-phenylhexan-2-yl] acetate Traditional Name: acetic acid [(1S)-1-[(R)-(dibenzylamino)-phenyl-methyl]-4-keto-pentyl] ester Formula: C28H31NO3 MolecularWeight: 429.55064

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)CCC(C(C1=CC=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)OC(=O)C

Isomeric SMILES

CC(=O)CC[C@@H]([C@@H](C1=CC=CC=C1)N(CC2=CC=CC=C2)CC3=CC=CC=C3)OC(=O)C

InChI

InChI=1S/C28H31NO3/c1-22(30)18-19-27(32-23(2)31)28(26-16-10-5-11-17-26)29(20-24-12-6-3-7-13-24)21-25-14-8-4-9-15-25/h3-17,27-28H,18-21H2,1-2H3/t27-,28+/m0/s1