(4R)-N-(4-ethanoylphenyl)-2-(4-methylpiperazin-1-ium-1-ylidene)-6-oxidanylidene-1,3-diazinane-4-carboxamide

Systemtic Name: (4R)-N-(4-ethanoylphenyl)-2-(4-methylpiperazin-1-ium-1-ylidene)-6-oxidanylidene-1,3-diazinane-4-carboxamide Openeye Name: (4R)-N-(4-acetylphenyl)-2-(4-methylpiperazin-1-ium-1-ylidene)-6-oxo-hexahydropyrimidine-4-carboxamide CAS Name: (4R)-N-(4-acetylphenyl)-2-(4-methyl-1-piperazin-1-iumylidene)-6-oxo-1,3-diazinane-4-carboxamide IUPAC Name: (4R)-N-(4-acetylphenyl)-2-(4-methylpiperazin-1-ium-1-ylidene)-6-oxo-1,3-diazinane-4-carboxamide Traditional Name: (4R)-N-(4-acetylphenyl)-6-keto-2-(4-methylpiperazin-1-ium-1-ylidene)hexahydropyrimidine-4-carboxamide Formula: C18H24N5O3+ MolecularWeight: 358.41486

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N5O3/c1-12(24)13-3-5-14(6-4-13)19-17(26)15-11-16(25)21-18(20-15)23-9-7-22(2)8-10-23/h3-6,15H,7-11H2,1-2H3,(H2,19,20,21,24,25,26)/p+1/t15-/m1/s1