(4R)-N-(4-methoxyphenyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-ylidene]-6-oxidanylidene-1,3-diazinane-4-carboxamide

Systemtic Name: (4R)-N-(4-methoxyphenyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-ylidene]-6-oxidanylidene-1,3-diazinane-4-carboxamide Openeye Name: (4R)-N-(4-methoxyphenyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-ylidene]-6-oxo-hexahydropyrimidine-4-carboxamide CAS Name: (4R)-N-(4-methoxyphenyl)-2-[4-(4-methoxyphenyl)-1-piperazin-1-iumylidene]-6-oxo-1,3-diazinane-4-carboxamide IUPAC Name: (4R)-N-(4-methoxyphenyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-ylidene]-6-oxo-1,3-diazinane-4-carboxamide Traditional Name: (4R)-6-keto-N-(4-methoxyphenyl)-2-[4-(4-methoxyphenyl)piperazin-1-ium-1-ylidene]hexahydropyrimidine-4-carboxamide Formula: C23H28N5O4+ MolecularWeight: 438.49952

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)C2CC(=O)NC(=[N+]3CCN(CC3)C4=CC=C(C=C4)OC)N2

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)[C@H]2CC(=O)NC(=[N+]3CCN(CC3)C4=CC=C(C=C4)OC)N2

InChI

InChI=1S/C23H27N5O4/c1-31-18-7-3-16(4-8-18)24-22(30)20-15-21(29)26-23(25-20)28-13-11-27(12-14-28)17-5-9-19(32-2)10-6-17/h3-10,20H,11-15H2,1-2H3,(H2,24,25,26,29,30)/p+1/t20-/m1/s1