4-butyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide

Systemtic Name: 4-butyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide Openeye Name: 4-butyl-N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide CAS Name: 4-butyl-N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-N-[2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 4-butyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide Traditional Name: 4-butyl-N-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide Formula: C24H35N4O3+ MolecularWeight: 427.5597

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)C(=O)N(CC[NH+]2CCCCC2)CC(=O)NC3=NOC(=C3)C

Isomeric SMILES

CCCCC1=CC=C(C=C1)C(=O)N(CC[NH+]2CCCCC2)CC(=O)NC3=NOC(=C3)C

InChI

InChI=1S/C24H34N4O3/c1-3-4-8-20-9-11-21(12-10-20)24(30)28(16-15-27-13-6-5-7-14-27)18-23(29)25-22-17-19(2)31-26-22/h9-12,17H,3-8,13-16,18H2,1-2H3,(H,25,26,29)/p+1