3-[(2-chlorophenyl)methyl]-N-phenyl-1,3-diazinan-3-ium-1-carboxamide

Systemtic Name: 3-[(2-chlorophenyl)methyl]-N-phenyl-1,3-diazinan-3-ium-1-carboxamide Openeye Name: 3-[(2-chlorophenyl)methyl]-N-phenyl-hexahydropyrimidin-3-ium-1-carboxamide CAS Name: 3-[(2-chlorophenyl)methyl]-N-phenyl-1,3-diazinan-3-ium-1-carboxamide IUPAC Name: 3-[(2-chlorophenyl)methyl]-N-phenyl-1,3-diazinan-3-ium-1-carboxamide Traditional Name: 3-(2-chlorobenzyl)-N-phenyl-hexahydropyrimidin-3-ium-1-carboxamide Formula: C18H21ClN3O+ MolecularWeight: 330.83184

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CN(C1)C(=O)NC2=CC=CC=C2)CC3=CC=CC=C3Cl

Isomeric SMILES

C1C[NH+](CN(C1)C(=O)NC2=CC=CC=C2)CC3=CC=CC=C3Cl

InChI

InChI=1S/C18H20ClN3O/c19-17-10-5-4-7-15(17)13-21-11-6-12-22(14-21)18(23)20-16-8-2-1-3-9-16/h1-5,7-10H,6,11-14H2,(H,20,23)/p+1