methyl 5-[[(3-cyanophenyl)carbonyl-methyl-amino]methyl]-2-methyl-furan-3-carboxylate

Systemtic Name: methyl 5-[[(3-cyanophenyl)carbonyl-methyl-amino]methyl]-2-methyl-furan-3-carboxylate Openeye Name: methyl 5-[[(3-cyanobenzoyl)-methyl-amino]methyl]-2-methyl-furan-3-carboxylate CAS Name: 5-[[[(3-cyanophenyl)-oxomethyl]-methylamino]methyl]-2-methyl-3-furancarboxylic acid methyl ester IUPAC Name: methyl 5-[[(3-cyanobenzoyl)-methylamino]methyl]-2-methylfuran-3-carboxylate Traditional Name: 5-[[(3-cyanobenzoyl)-methyl-amino]methyl]-2-methyl-furan-3-carboxylic acid methyl ester Formula: C17H16N2O4 MolecularWeight: 312.31994

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(O1)CN(C)C(=O)C2=CC=CC(=C2)C#N)C(=O)OC

Isomeric SMILES

CC1=C(C=C(O1)CN(C)C(=O)C2=CC=CC(=C2)C#N)C(=O)OC

InChI

InChI=1S/C17H16N2O4/c1-11-15(17(21)22-3)8-14(23-11)10-19(2)16(20)13-6-4-5-12(7-13)9-18/h4-8H,10H2,1-3H3