cyclopentyl-[4-(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)piperazin-1-yl]methanone

Systemtic Name: cyclopentyl-[4-(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)piperazin-1-yl]methanone Openeye Name: cyclopentyl-[4-(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)piperazin-1-yl]methanone CAS Name: [4-[4,6-bis(1-pyrrolidinyl)-1,3,5-triazin-5-ium-2-yl]-1-piperazinyl]-cyclopentylmethanone IUPAC Name: cyclopentyl-[4-(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)piperazin-1-yl]methanone Traditional Name: cyclopentyl-[4-(4,6-dipyrrolidino-s-triazin-5-ium-2-yl)piperazino]methanone Formula: C21H34N7O+ MolecularWeight: 400.54096

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(C1)C(=O)N2CCN(CC2)C3=NC(=[NH+]C(=N3)N4CCCC4)N5CCCC5

Isomeric SMILES

C1CCC(C1)C(=O)N2CCN(CC2)C3=NC(=[NH+]C(=N3)N4CCCC4)N5CCCC5

InChI

InChI=1S/C21H33N7O/c29-18(17-7-1-2-8-17)25-13-15-28(16-14-25)21-23-19(26-9-3-4-10-26)22-20(24-21)27-11-5-6-12-27/h17H,1-16H2/p+1