3-[4-(4-methylpiperazine-1,4-diium-1-yl)butyl]quinazolin-4-one

Systemtic Name: 3-[4-(4-methylpiperazine-1,4-diium-1-yl)butyl]quinazolin-4-one Openeye Name: 3-[4-(4-methylpiperazine-1,4-diium-1-yl)butyl]quinazolin-4-one CAS Name: 3-[4-(4-methyl-1-piperazine-1,4-diiumyl)butyl]-4-quinazolinone IUPAC Name: 3-[4-(4-methylpiperazine-1,4-diium-1-yl)butyl]quinazolin-4-one Traditional Name: 3-[4-(4-methylpiperazine-1,4-diium-1-yl)butyl]quinazolin-4-one Formula: C17H26N4O+2 MolecularWeight: 302.41454

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+]1CC[NH+](CC1)CCCCN2C=NC3=CC=CC=C3C2=O

Isomeric SMILES

C[NH+]1CC[NH+](CC1)CCCCN2C=NC3=CC=CC=C3C2=O

InChI

InChI=1S/C17H24N4O/c1-19-10-12-20(13-11-19)8-4-5-9-21-14-18-16-7-3-2-6-15(16)17(21)22/h2-3,6-7,14H,4-5,8-13H2,1H3/p+2