N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide

Systemtic Name: N-[1-(2-azanyl-2-oxidanylidene-ethyl)piperidin-1-ium-4-yl]-3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide Openeye Name: N-[1-(2-amino-2-oxo-ethyl)piperidin-1-ium-4-yl]-3-[(3,5-dimethylisoxazol-4-yl)methoxy]benzamide CAS Name: N-[1-(2-amino-2-oxoethyl)-4-piperidin-1-iumyl]-3-[(3,5-dimethyl-4-isoxazolyl)methoxy]benzamide IUPAC Name: N-[1-(2-amino-2-oxoethyl)piperidin-1-ium-4-yl]-3-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]benzamide Traditional Name: N-[1-(2-amino-2-keto-ethyl)piperidin-1-ium-4-yl]-3-[(3,5-dimethylisoxazol-4-yl)methoxy]benzamide Formula: C20H27N4O4+ MolecularWeight: 387.45278

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NO1)C)COC2=CC=CC(=C2)C(=O)NC3CC[NH+](CC3)CC(=O)N

Isomeric SMILES

CC1=C(C(=NO1)C)COC2=CC=CC(=C2)C(=O)NC3CC[NH+](CC3)CC(=O)N

InChI

InChI=1S/C20H26N4O4/c1-13-18(14(2)28-23-13)12-27-17-5-3-4-15(10-17)20(26)22-16-6-8-24(9-7-16)11-19(21)25/h3-5,10,16H,6-9,11-12H2,1-2H3,(H2,21,25)(H,22,26)/p+1