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

Systemtic Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(pyrrolidin-1-ium-1-ylmethyl)quinazoline Openeye Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(pyrrolidin-1-ium-1-ylmethyl)quinazoline CAS Name: 4-(4-methyl-1-piperazin-4-iumyl)-2-(1-pyrrolidin-1-iumylmethyl)quinazoline IUPAC Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(pyrrolidin-1-ium-1-ylmethyl)quinazoline Traditional Name: 4-(4-methylpiperazin-4-ium-1-yl)-2-(pyrrolidin-1-ium-1-ylmethyl)quinazoline Formula: C18H27N5+2 MolecularWeight: 313.44048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C[NH+]4CCCC4

Isomeric SMILES

C[NH+]1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C[NH+]4CCCC4

InChI

InChI=1S/C18H25N5/c1-21-10-12-23(13-11-21)18-15-6-2-3-7-16(15)19-17(20-18)14-22-8-4-5-9-22/h2-3,6-7H,4-5,8-14H2,1H3/p+2