N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-(5-cyano-2,4-dimethyl-6-oxidanylidene-1H-pyridin-3-yl)propanamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-3-(5-cyano-2,4-dimethyl-6-oxo-1H-pyridin-3-yl)propanamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-3-(5-cyano-6-keto-2,4-dimethyl-1H-pyridin-3-yl)propionamide Formula: C18H26N5O3+ MolecularWeight: 360.43074

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=O)NC(=C1CCC(=O)NC2CC[NH+](CC2)CC(=O)N)C)C#N

Isomeric SMILES

CC1=C(C(=O)NC(=C1CCC(=O)NC2CC[NH+](CC2)CC(=O)N)C)C#N

InChI

InChI=1S/C18H25N5O3/c1-11-14(12(2)21-18(26)15(11)9-19)3-4-17(25)22-13-5-7-23(8-6-13)10-16(20)24/h13H,3-8,10H2,1-2H3,(H2,20,24)(H,21,26)(H,22,25)/p+1