N-cyclohexyl-4-(4-phenylphthalazin-2-ium-1-yl)piperazine-1-carboxamide

Systemtic Name: N-cyclohexyl-4-(4-phenylphthalazin-2-ium-1-yl)piperazine-1-carboxamide Openeye Name: N-cyclohexyl-4-(4-phenylphthalazin-2-ium-1-yl)piperazine-1-carboxamide CAS Name: N-cyclohexyl-4-(4-phenyl-1-phthalazin-2-iumyl)-1-piperazinecarboxamide IUPAC Name: N-cyclohexyl-4-(4-phenylphthalazin-2-ium-1-yl)piperazine-1-carboxamide Traditional Name: N-cyclohexyl-4-(4-phenylphthalazin-2-ium-1-yl)piperazine-1-carboxamide Formula: C25H30N5O+ MolecularWeight: 416.5386

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=O)N2CCN(CC2)C3=[NH+]N=C(C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

C1CCC(CC1)NC(=O)N2CCN(CC2)C3=[NH+]N=C(C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C25H29N5O/c31-25(26-20-11-5-2-6-12-20)30-17-15-29(16-18-30)24-22-14-8-7-13-21(22)23(27-28-24)19-9-3-1-4-10-19/h1,3-4,7-10,13-14,20H,2,5-6,11-12,15-18H2,(H,26,31)/p+1