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

Systemtic Name: 3-methoxy-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxidanylidene-ethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide Openeye Name: 3-methoxy-N-[2-[(5-methylisoxazol-3-yl)amino]-2-oxo-ethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide CAS Name: 3-methoxy-N-[2-[(5-methyl-3-isoxazolyl)amino]-2-oxoethyl]-N-[2-(1-piperidin-1-iumyl)ethyl]benzamide IUPAC Name: 3-methoxy-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-N-(2-piperidin-1-ium-1-ylethyl)benzamide Traditional Name: N-[2-keto-2-[(5-methylisoxazol-3-yl)amino]ethyl]-3-methoxy-N-(2-piperidin-1-ium-1-ylethyl)benzamide Formula: C21H29N4O4+ MolecularWeight: 401.47936

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CN(CC[NH+]2CCCCC2)C(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CN(CC[NH+]2CCCCC2)C(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C21H28N4O4/c1-16-13-19(23-29-16)22-20(26)15-25(12-11-24-9-4-3-5-10-24)21(27)17-7-6-8-18(14-17)28-2/h6-8,13-14H,3-5,9-12,15H2,1-2H3,(H,22,23,26)/p+1