2-[(1R)-1-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(1R)-1-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1R)-1-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[(1R)-1-[4-[(4-methoxyphenyl)methyl]-1-piperazine-1,4-diiumyl]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1R)-1-[4-[(4-methoxyphenyl)methyl]piperazine-1,4-diium-1-yl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1R)-1-(4-p-anisylpiperazine-1,4-diium-1-yl)ethyl]-1H-quinazolin-4-one Formula: C22H28N4O2+2 MolecularWeight: 380.48332

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)[NH+]3CC[NH+](CC3)CC4=CC=C(C=C4)OC

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)[NH+]3CC[NH+](CC3)CC4=CC=C(C=C4)OC

InChI

InChI=1S/C22H26N4O2/c1-16(21-23-20-6-4-3-5-19(20)22(27)24-21)26-13-11-25(12-14-26)15-17-7-9-18(28-2)10-8-17/h3-10,16H,11-15H2,1-2H3,(H,23,24,27)/p+2/t16-/m1/s1