methyl N-(2-methylphenyl)carbonyl-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate

Systemtic Name: methyl N-(2-methylphenyl)carbonyl-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate Openeye Name: N-[C-methoxy-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]-2-methyl-benzamide CAS Name: N-[(2-methylphenyl)-oxomethyl]-N'-[3-(4-morpholin-4-iumyl)propyl]carbamimidic acid methyl ester IUPAC Name: methyl N-(2-methylbenzoyl)-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate Traditional Name: N-[C-methoxy-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]-2-methyl-benzamide Formula: C17H26N3O3+ MolecularWeight: 320.40664

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(=NCCC[NH+]2CCOCC2)OC

Isomeric SMILES

CC1=CC=CC=C1C(=O)NC(=NCCC[NH+]2CCOCC2)OC

InChI

InChI=1S/C17H25N3O3/c1-14-6-3-4-7-15(14)16(21)19-17(22-2)18-8-5-9-20-10-12-23-13-11-20/h3-4,6-7H,5,8-13H2,1-2H3,(H,18,19,21)/p+1