methyl 4-[2-[(1-cyano-1-cyclopropyl-ethyl)amino]-2-oxidanylidene-ethoxy]benzoate

Systemtic Name: methyl 4-[2-[(1-cyano-1-cyclopropyl-ethyl)amino]-2-oxidanylidene-ethoxy]benzoate Openeye Name: methyl 4-[2-[(1-cyano-1-cyclopropyl-ethyl)amino]-2-oxo-ethoxy]benzoate CAS Name: 4-[2-[(1-cyano-1-cyclopropylethyl)amino]-2-oxoethoxy]benzoic acid methyl ester IUPAC Name: methyl 4-[2-[(1-cyano-1-cyclopropylethyl)amino]-2-oxoethoxy]benzoate Traditional Name: 4-[2-[(1-cyano-1-cyclopropyl-ethyl)amino]-2-keto-ethoxy]benzoic acid methyl ester Formula: C16H18N2O4 MolecularWeight: 302.32512

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C#N)(C1CC1)NC(=O)COC2=CC=C(C=C2)C(=O)OC

Isomeric SMILES

CC(C#N)(C1CC1)NC(=O)COC2=CC=C(C=C2)C(=O)OC

InChI

InChI=1S/C16H18N2O4/c1-16(10-17,12-5-6-12)18-14(19)9-22-13-7-3-11(4-8-13)15(20)21-2/h3-4,7-8,12H,5-6,9H2,1-2H3,(H,18,19)