4-piperazin-4-ium-1-yl-2-(pyrrolidin-1-ium-1-ylmethyl)quinazoline

Systemtic Name: 4-piperazin-4-ium-1-yl-2-(pyrrolidin-1-ium-1-ylmethyl)quinazoline Openeye Name: 4-piperazin-4-ium-1-yl-2-(pyrrolidin-1-ium-1-ylmethyl)quinazoline CAS Name: 4-(1-piperazin-4-iumyl)-2-(1-pyrrolidin-1-iumylmethyl)quinazoline IUPAC Name: 4-piperazin-4-ium-1-yl-2-(pyrrolidin-1-ium-1-ylmethyl)quinazoline Traditional Name: 4-piperazin-4-ium-1-yl-2-(pyrrolidin-1-ium-1-ylmethyl)quinazoline Formula: C17H25N5+2 MolecularWeight: 299.4139

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CC2=NC3=CC=CC=C3C(=N2)N4CC[NH2+]CC4

Isomeric SMILES

C1CC[NH+](C1)CC2=NC3=CC=CC=C3C(=N2)N4CC[NH2+]CC4

InChI

InChI=1S/C17H23N5/c1-2-6-15-14(5-1)17(22-11-7-18-8-12-22)20-16(19-15)13-21-9-3-4-10-21/h1-2,5-6,18H,3-4,7-13H2/p+2