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

Systemtic Name: ethyl (3S,5R)-5-methyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]heptanoate Openeye Name: ethyl (3S,5R)-3-[benzyl-[(1S)-1-phenylethyl]amino]-5-methyl-heptanoate CAS Name: (3S,5R)-5-methyl-3-[[(1S)-1-phenylethyl]-(phenylmethyl)amino]heptanoic acid ethyl ester IUPAC Name: ethyl (3S,5R)-3-[benzyl-[(1S)-1-phenylethyl]amino]-5-methylheptanoate Traditional Name: (3S,5R)-3-[benzyl-[(1S)-1-phenylethyl]amino]-5-methyl-enanthic acid ethyl ester Formula: C25H35NO2 MolecularWeight: 381.5509

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C25H35NO2/c1-5-20(3)17-24(18-25(27)28-6-2)26(19-22-13-9-7-10-14-22)21(4)23-15-11-8-12-16-23/h7-16,20-21,24H,5-6,17-19H2,1-4H3/t20-,21+,24+/m1/s1