ethyl (3S)-12-phenyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]dodecanoate

Systemtic Name: ethyl (3S)-12-phenyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]dodecanoate Openeye Name: ethyl (3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-12-phenyl-dodecanoate CAS Name: (3S)-12-phenyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]dodecanoic acid ethyl ester IUPAC Name: ethyl (3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-12-phenyldodecanoate Traditional Name: (3S)-3-[benzyl-[(1S)-1-phenylethyl]amino]-12-phenyl-lauric acid ethyl ester Formula: C35H47NO2 MolecularWeight: 513.75318

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CCCCCCCCCC1=CC=CC=C1)N(CC2=CC=CC=C2)C(C)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C[C@H](CCCCCCCCCC1=CC=CC=C1)N(CC2=CC=CC=C2)[C@@H](C)C3=CC=CC=C3

InChI

InChI=1S/C35H47NO2/c1-3-38-35(37)28-34(27-19-8-6-4-5-7-12-20-31-21-13-9-14-22-31)36(29-32-23-15-10-16-24-32)30(2)33-25-17-11-18-26-33/h9-11,13-18,21-26,30,34H,3-8,12,19-20,27-29H2,1-2H3/t30-,34-/m0/s1