(2S)-1-methyl-2-phenyl-3-[(Z)-(phenylmethylidene)amino]-1,3-diazinan-1-ium-4-one

Systemtic Name: (2S)-1-methyl-2-phenyl-3-[(Z)-(phenylmethylidene)amino]-1,3-diazinan-1-ium-4-one Openeye Name: (2S)-3-[(Z)-benzylideneamino]-1-methyl-2-phenyl-hexahydropyrimidin-1-ium-4-one CAS Name: (2S)-1-methyl-2-phenyl-3-[(Z)-(phenylmethylene)amino]-1,3-diazinan-1-ium-4-one IUPAC Name: (2S)-3-[(Z)-benzylideneamino]-1-methyl-2-phenyl-1,3-diazinan-1-ium-4-one Traditional Name: (2S)-3-[(Z)-benzalamino]-1-methyl-2-phenyl-hexahydropyrimidin-1-ium-4-one Formula: C18H20N3O+ MolecularWeight: 294.3709

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCC(=O)N(C1C2=CC=CC=C2)N=CC3=CC=CC=C3

Isomeric SMILES

C[NH+]1CCC(=O)N([C@H]1C2=CC=CC=C2)/N=C\C3=CC=CC=C3

InChI

InChI=1S/C18H19N3O/c1-20-13-12-17(22)21(18(20)16-10-6-3-7-11-16)19-14-15-8-4-2-5-9-15/h2-11,14,18H,12-13H2,1H3/p+1/b19-14-/t18-/m0/s1