ethyl (3S,5R)-5-methyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]nonanoate

Systemtic Name: ethyl (3S,5R)-5-methyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]nonanoate Openeye Name: ethyl (3S,5R)-3-[benzyl-[(1S)-1-phenylethyl]amino]-5-methyl-nonanoate CAS Name: (3S,5R)-5-methyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]nonanoic acid ethyl ester IUPAC Name: ethyl (3S,5R)-3-[benzyl-[(1S)-1-phenylethyl]amino]-5-methylnonanoate Traditional Name: (3S,5R)-3-[benzyl-[(1S)-1-phenylethyl]amino]-5-methyl-pelargonic acid ethyl ester Formula: C27H39NO2 MolecularWeight: 409.60406

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(C)CC(CC(=O)OCC)N(CC1=CC=CC=C1)C(C)C2=CC=CC=C2

Isomeric SMILES

CCCC[C@@H](C)C[C@@H](CC(=O)OCC)N(CC1=CC=CC=C1)[C@@H](C)C2=CC=CC=C2

InChI

InChI=1S/C27H39NO2/c1-5-7-14-22(3)19-26(20-27(29)30-6-2)28(21-24-15-10-8-11-16-24)23(4)25-17-12-9-13-18-25/h8-13,15-18,22-23,26H,5-7,14,19-21H2,1-4H3/t22-,23+,26+/m1/s1