ethyl (2R,3S)-3-chloranyl-3-phenyl-2-(4-phenylpiperazin-1-yl)propanoate

Systemtic Name: ethyl (2R,3S)-3-chloranyl-3-phenyl-2-(4-phenylpiperazin-1-yl)propanoate Openeye Name: ethyl (2R,3S)-3-chloro-3-phenyl-2-(4-phenylpiperazin-1-yl)propanoate CAS Name: (2R,3S)-3-chloro-3-phenyl-2-(4-phenyl-1-piperazinyl)propanoic acid ethyl ester IUPAC Name: ethyl (2R,3S)-3-chloro-3-phenyl-2-(4-phenylpiperazin-1-yl)propanoate Traditional Name: (2R,3S)-3-chloro-3-phenyl-2-(4-phenylpiperazino)propionic acid ethyl ester Formula: C21H25ClN2O2 MolecularWeight: 372.8884

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C(C1=CC=CC=C1)Cl)N2CCN(CC2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)[C@H]([C@H](C1=CC=CC=C1)Cl)N2CCN(CC2)C3=CC=CC=C3

InChI

InChI=1S/C21H25ClN2O2/c1-2-26-21(25)20(19(22)17-9-5-3-6-10-17)24-15-13-23(14-16-24)18-11-7-4-8-12-18/h3-12,19-20H,2,13-16H2,1H3/t19-,20-/m0/s1