ethyl 2-[(2S,3S,4R)-2-cyano-4-phenyl-1-(phenylmethyl)azetidin-3-yl]ethanoate

Systemtic Name: ethyl 2-[(2S,3S,4R)-2-cyano-4-phenyl-1-(phenylmethyl)azetidin-3-yl]ethanoate Openeye Name: ethyl 2-[(2S,3S,4R)-1-benzyl-2-cyano-4-phenyl-azetidin-3-yl]acetate CAS Name: 2-[(2S,3S,4R)-2-cyano-4-phenyl-1-(phenylmethyl)-3-azetidinyl]acetic acid ethyl ester IUPAC Name: ethyl 2-[(2S,3S,4R)-1-benzyl-2-cyano-4-phenylazetidin-3-yl]acetate Traditional Name: 2-[(2S,3S,4R)-1-benzyl-2-cyano-4-phenyl-azetidin-3-yl]acetic acid ethyl ester Formula: C21H22N2O2 MolecularWeight: 334.41158

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC1C(N(C1C2=CC=CC=C2)CC3=CC=CC=C3)C#N

Isomeric SMILES

CCOC(=O)C[C@@H]1[C@H](N([C@H]1C2=CC=CC=C2)CC3=CC=CC=C3)C#N

InChI

InChI=1S/C21H22N2O2/c1-2-25-20(24)13-18-19(14-22)23(15-16-9-5-3-6-10-16)21(18)17-11-7-4-8-12-17/h3-12,18-19,21H,2,13,15H2,1H3/t18-,19-,21+/m1/s1