3-ethyl-2-[(1R)-1-piperazine-1,4-diium-1-ylpropyl]quinazolin-4-one

Systemtic Name: 3-ethyl-2-[(1R)-1-piperazine-1,4-diium-1-ylpropyl]quinazolin-4-one Openeye Name: 3-ethyl-2-[(1R)-1-piperazine-1,4-diium-1-ylpropyl]quinazolin-4-one CAS Name: 3-ethyl-2-[(1R)-1-(1-piperazine-1,4-diiumyl)propyl]-4-quinazolinone IUPAC Name: 3-ethyl-2-[(1R)-1-piperazine-1,4-diium-1-ylpropyl]quinazolin-4-one Traditional Name: 3-ethyl-2-[(1R)-1-piperazine-1,4-diium-1-ylpropyl]quinazolin-4-one Formula: C17H26N4O+2 MolecularWeight: 302.41454

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C1=NC2=CC=CC=C2C(=O)N1CC)[NH+]3CC[NH2+]CC3

Isomeric SMILES

CC[C@H](C1=NC2=CC=CC=C2C(=O)N1CC)[NH+]3CC[NH2+]CC3

InChI

InChI=1S/C17H24N4O/c1-3-15(20-11-9-18-10-12-20)16-19-14-8-6-5-7-13(14)17(22)21(16)4-2/h5-8,15,18H,3-4,9-12H2,1-2H3/p+2/t15-/m1/s1