propyl N-(3-methylphenyl)carbonyl-N'-(pyridin-3-ylmethyl)carbamimidate

Systemtic Name: propyl N-(3-methylphenyl)carbonyl-N'-(pyridin-3-ylmethyl)carbamimidate Openeye Name: 3-methyl-N-[C-propoxy-N-(3-pyridylmethyl)carbonimidoyl]benzamide CAS Name: N-[(3-methylphenyl)-oxomethyl]-N'-(3-pyridinylmethyl)carbamimidic acid propyl ester IUPAC Name: propyl N-(3-methylbenzoyl)-N'-(pyridin-3-ylmethyl)carbamimidate Traditional Name: 3-methyl-N-[C-propoxy-N-(3-pyridylmethyl)carbonimidoyl]benzamide Formula: C18H21N3O2 MolecularWeight: 311.37824

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=NCC1=CN=CC=C1)NC(=O)C2=CC(=CC=C2)C

Isomeric SMILES

CCCOC(=NCC1=CN=CC=C1)NC(=O)C2=CC(=CC=C2)C

InChI

InChI=1S/C18H21N3O2/c1-3-10-23-18(20-13-15-7-5-9-19-12-15)21-17(22)16-8-4-6-14(2)11-16/h4-9,11-12H,3,10,13H2,1-2H3,(H,20,21,22)