3-(4-pyrrolidin-1-ium-1-ylbutyl)quinazolin-4-one

Systemtic Name: 3-(4-pyrrolidin-1-ium-1-ylbutyl)quinazolin-4-one Openeye Name: 3-(4-pyrrolidin-1-ium-1-ylbutyl)quinazolin-4-one CAS Name: 3-[4-(1-pyrrolidin-1-iumyl)butyl]-4-quinazolinone IUPAC Name: 3-(4-pyrrolidin-1-ium-1-ylbutyl)quinazolin-4-one Traditional Name: 3-(4-pyrrolidin-1-ium-1-ylbutyl)quinazolin-4-one Formula: C16H22N3O+ MolecularWeight: 272.36538

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Descriptors Computed from Structure

Canonical SMILES:

C1CC[NH+](C1)CCCCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C1CC[NH+](C1)CCCCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C16H21N3O/c20-16-14-7-1-2-8-15(14)17-13-19(16)12-6-5-11-18-9-3-4-10-18/h1-2,7-8,13H,3-6,9-12H2/p+1