ethyl (2R,3R)-3-[(3,4-dichlorophenyl)amino]-2-phenyl-3-pyridin-2-yl-propanoate

Systemtic Name: ethyl (2R,3R)-3-[(3,4-dichlorophenyl)amino]-2-phenyl-3-pyridin-2-yl-propanoate Openeye Name: ethyl (2R,3R)-3-(3,4-dichloroanilino)-2-phenyl-3-(2-pyridyl)propanoate CAS Name: (2R,3R)-3-(3,4-dichloroanilino)-2-phenyl-3-(2-pyridinyl)propanoic acid ethyl ester IUPAC Name: ethyl (2R,3R)-3-(3,4-dichloroanilino)-2-phenyl-3-pyridin-2-ylpropanoate Traditional Name: (2R,3R)-3-(3,4-dichloroanilino)-2-phenyl-3-(2-pyridyl)propionic acid ethyl ester Formula: C22H20Cl2N2O2 MolecularWeight: 415.3124

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(C1=CC=CC=C1)C(C2=CC=CC=N2)NC3=CC(=C(C=C3)Cl)Cl

Isomeric SMILES

CCOC(=O)[C@H](C1=CC=CC=C1)[C@H](C2=CC=CC=N2)NC3=CC(=C(C=C3)Cl)Cl

InChI

InChI=1S/C22H20Cl2N2O2/c1-2-28-22(27)20(15-8-4-3-5-9-15)21(19-10-6-7-13-25-19)26-16-11-12-17(23)18(24)14-16/h3-14,20-21,26H,2H2,1H3/t20-,21+/m1/s1