2-methylpropyl N-(3,4-dichlorophenyl)carbonyl-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate

Systemtic Name: 2-methylpropyl N-(3,4-dichlorophenyl)carbonyl-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate Openeye Name: 3,4-dichloro-N-[C-isobutoxy-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]benzamide CAS Name: N-[(3,4-dichlorophenyl)-oxomethyl]-N'-[3-(4-morpholin-4-iumyl)propyl]carbamimidic acid 2-methylpropyl ester IUPAC Name: 2-methylpropyl N-(3,4-dichlorobenzoyl)-N'-(3-morpholin-4-ium-4-ylpropyl)carbamimidate Traditional Name: 3,4-dichloro-N-[C-isobutoxy-N-(3-morpholin-4-ium-4-ylpropyl)carbonimidoyl]benzamide Formula: C19H28Cl2N3O3+ MolecularWeight: 417.34992

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)COC(=NCCC[NH+]1CCOCC1)NC(=O)C2=CC(=C(C=C2)Cl)Cl

Isomeric SMILES

CC(C)COC(=NCCC[NH+]1CCOCC1)NC(=O)C2=CC(=C(C=C2)Cl)Cl

InChI

InChI=1S/C19H27Cl2N3O3/c1-14(2)13-27-19(22-6-3-7-24-8-10-26-11-9-24)23-18(25)15-4-5-16(20)17(21)12-15/h4-5,12,14H,3,6-11,13H2,1-2H3,(H,22,23,25)/p+1