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

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

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NO1)NC(=O)CN(CC[NH+]2CCCC2)C(=O)C3=CC(=CC=C3)OC

Isomeric SMILES

CC1=CC(=NO1)NC(=O)CN(CC[NH+]2CCCC2)C(=O)C3=CC(=CC=C3)OC

InChI

InChI=1S/C20H26N4O4/c1-15-12-18(22-28-15)21-19(25)14-24(11-10-23-8-3-4-9-23)20(26)16-6-5-7-17(13-16)27-2/h5-7,12-13H,3-4,8-11,14H2,1-2H3,(H,21,22,25)/p+1