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

Systemtic Name: [4-(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)piperazin-1-yl]-(2-methoxyphenyl)methanone Openeye Name: [4-(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)piperazin-1-yl]-(2-methoxyphenyl)methanone CAS Name: [4-[4,6-bis(1-pyrrolidinyl)-1,3,5-triazin-5-ium-2-yl]-1-piperazinyl]-(2-methoxyphenyl)methanone IUPAC Name: [4-(4,6-dipyrrolidin-1-yl-1,3,5-triazin-5-ium-2-yl)piperazin-1-yl]-(2-methoxyphenyl)methanone Traditional Name: [4-(4,6-dipyrrolidino-s-triazin-5-ium-2-yl)piperazino]-(2-methoxyphenyl)methanone Formula: C23H32N7O2+ MolecularWeight: 438.54588

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC(=[NH+]C(=N3)N4CCCC4)N5CCCC5

Isomeric SMILES

COC1=CC=CC=C1C(=O)N2CCN(CC2)C3=NC(=[NH+]C(=N3)N4CCCC4)N5CCCC5

InChI

InChI=1S/C23H31N7O2/c1-32-19-9-3-2-8-18(19)20(31)27-14-16-30(17-15-27)23-25-21(28-10-4-5-11-28)24-22(26-23)29-12-6-7-13-29/h2-3,8-9H,4-7,10-17H2,1H3/p+1