dimethyl (2S,3R)-2-(4-chlorophenyl)carbonyl-2-ethyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarboxylate

Systemtic Name: dimethyl (2S,3R)-2-(4-chlorophenyl)carbonyl-2-ethyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarboxylate Openeye Name: dimethyl (2S,3R)-2-(4-chlorobenzoyl)-2-ethyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarboxylate CAS Name: (2S,3R)-2-[(4-chlorophenyl)-oxomethyl]-2-ethyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (2S,3R)-2-(4-chlorobenzoyl)-2-ethyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarboxylate Traditional Name: (2S,3R)-2-(4-chlorobenzoyl)-2-ethyl-3-(4-nitrophenyl)cyclopropane-1,1-dicarboxylic acid dimethyl ester Formula: C22H20ClNO7 MolecularWeight: 445.8497

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC1(C(C1(C(=O)OC)C(=O)OC)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CC[C@@]1([C@H](C1(C(=O)OC)C(=O)OC)C2=CC=C(C=C2)[N+](=O)[O-])C(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C22H20ClNO7/c1-4-21(18(25)14-5-9-15(23)10-6-14)17(13-7-11-16(12-8-13)24(28)29)22(21,19(26)30-2)20(27)31-3/h5-12,17H,4H2,1-3H3/t17-,21-/m1/s1