methyl (2S,3S)-3-(4-chlorophenyl)-3-pyrrolidin-1-yl-2-(pyrrolidin-1-ylmethyl)propanoate

Systemtic Name: methyl (2S,3S)-3-(4-chlorophenyl)-3-pyrrolidin-1-yl-2-(pyrrolidin-1-ylmethyl)propanoate Openeye Name: methyl (2S,3S)-3-(4-chlorophenyl)-3-pyrrolidin-1-yl-2-(pyrrolidin-1-ylmethyl)propanoate CAS Name: (2S,3S)-3-(4-chlorophenyl)-3-(1-pyrrolidinyl)-2-(1-pyrrolidinylmethyl)propanoic acid methyl ester IUPAC Name: methyl (2S,3S)-3-(4-chlorophenyl)-3-pyrrolidin-1-yl-2-(pyrrolidin-1-ylmethyl)propanoate Traditional Name: (2S,3S)-3-(4-chlorophenyl)-3-pyrrolidino-2-(pyrrolidinomethyl)propionic acid methyl ester Formula: C19H27ClN2O2 MolecularWeight: 350.88288

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CN1CCCC1)C(C2=CC=C(C=C2)Cl)N3CCCC3

Isomeric SMILES

COC(=O)[C@@H](CN1CCCC1)[C@@H](C2=CC=C(C=C2)Cl)N3CCCC3

InChI

InChI=1S/C19H27ClN2O2/c1-24-19(23)17(14-21-10-2-3-11-21)18(22-12-4-5-13-22)15-6-8-16(20)9-7-15/h6-9,17-18H,2-5,10-14H2,1H3/t17-,18+/m0/s1