N-[azanyl-[4-(4-methylphenyl)carbonylpiperazin-1-ium-1-ylidene]methyl]nitramide

Systemtic Name: N-[azanyl-[4-(4-methylphenyl)carbonylpiperazin-1-ium-1-ylidene]methyl]nitramide Openeye Name: N-[amino-[4-(4-methylbenzoyl)piperazin-1-ium-1-ylidene]methyl]nitramide CAS Name: N-[amino-[4-[(4-methylphenyl)-oxomethyl]-1-piperazin-1-iumylidene]methyl]nitramide IUPAC Name: N-[amino-[4-(4-methylbenzoyl)piperazin-1-ium-1-ylidene]methyl]nitramide Traditional Name: N-[amino-(4-p-toluoylpiperazin-1-ium-1-ylidene)methyl]nitramide Formula: C13H18N5O3+ MolecularWeight: 292.31372

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)C(=O)N2CC[N+](=C(N)N[N+](=O)[O-])CC2

Isomeric SMILES

CC1=CC=C(C=C1)C(=O)N2CC[N+](=C(N)N[N+](=O)[O-])CC2

InChI

InChI=1S/C13H17N5O3/c1-10-2-4-11(5-3-10)12(19)16-6-8-17(9-7-16)13(14)15-18(20)21/h2-5H,6-9H2,1H3,(H2,14,15)/p+1