ethyl (2S,3R)-3-cyclohexyl-2-[methyl-(phenylmethyl)amino]-3-oxidanyl-propanoate

Systemtic Name: ethyl (2S,3R)-3-cyclohexyl-2-[methyl-(phenylmethyl)amino]-3-oxidanyl-propanoate Openeye Name: ethyl (2S,3R)-2-[benzyl(methyl)amino]-3-cyclohexyl-3-hydroxy-propanoate CAS Name: (2S,3R)-3-cyclohexyl-3-hydroxy-2-[methyl-(phenylmethyl)amino]propanoic acid ethyl ester IUPAC Name: ethyl (2S,3R)-2-[benzyl(methyl)amino]-3-cyclohexyl-3-hydroxypropanoate Traditional Name: (2S,3R)-2-[benzyl(methyl)amino]-3-cyclohexyl-3-hydroxy-propionic acid ethyl ester Formula: C19H29NO3 MolecularWeight: 319.43846

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1CCCCC1)O)N(C)CC2=CC=CC=C2

Isomeric SMILES

CCOC(=O)[C@H]([C@@H](C1CCCCC1)O)N(C)CC2=CC=CC=C2

InChI

InChI=1S/C19H29NO3/c1-3-23-19(22)17(18(21)16-12-8-5-9-13-16)20(2)14-15-10-6-4-7-11-15/h4,6-7,10-11,16-18,21H,3,5,8-9,12-14H2,1-2H3/t17-,18+/m0/s1