1-[4-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]piperazin-1-yl]ethanone

Systemtic Name: 1-[4-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]piperazin-1-yl]ethanone Openeye Name: 1-[4-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]piperazin-1-yl]ethanone CAS Name: 1-[4-[2-(1-pyrrolidin-1-iumylmethyl)-4-quinazolinyl]-1-piperazinyl]ethanone IUPAC Name: 1-[4-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]piperazin-1-yl]ethanone Traditional Name: 1-[4-[2-(pyrrolidin-1-ium-1-ylmethyl)quinazolin-4-yl]piperazino]ethanone Formula: C19H26N5O+ MolecularWeight: 340.44264

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C[NH+]4CCCC4

Isomeric SMILES

CC(=O)N1CCN(CC1)C2=NC(=NC3=CC=CC=C32)C[NH+]4CCCC4

InChI

InChI=1S/C19H25N5O/c1-15(25)23-10-12-24(13-11-23)19-16-6-2-3-7-17(16)20-18(21-19)14-22-8-4-5-9-22/h2-3,6-7H,4-5,8-14H2,1H3/p+1