methyl (1R,2S)-2-cyano-2-[(4-methylphenyl)carbamoyl]cyclopropane-1-carboxylate

Systemtic Name: methyl (1R,2S)-2-cyano-2-[(4-methylphenyl)carbamoyl]cyclopropane-1-carboxylate Openeye Name: methyl (1R,2S)-2-cyano-2-(p-tolylcarbamoyl)cyclopropanecarboxylate CAS Name: (1R,2S)-2-cyano-2-[(4-methylanilino)-oxomethyl]-1-cyclopropanecarboxylic acid methyl ester IUPAC Name: methyl (1R,2S)-2-cyano-2-[(4-methylphenyl)carbamoyl]cyclopropane-1-carboxylate Traditional Name: (1R,2S)-2-cyano-2-(p-tolylcarbamoyl)cyclopropanecarboxylic acid methyl ester Formula: C14H14N2O3 MolecularWeight: 258.27256

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)NC(=O)C2(CC2C(=O)OC)C#N

Isomeric SMILES

CC1=CC=C(C=C1)NC(=O)[C@]2(C[C@H]2C(=O)OC)C#N

InChI

InChI=1S/C14H14N2O3/c1-9-3-5-10(6-4-9)16-13(18)14(8-15)7-11(14)12(17)19-2/h3-6,11H,7H2,1-2H3,(H,16,18)/t11-,14+/m0/s1