1-[1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-yl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one

Systemtic Name: 1-[1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-yl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one Openeye Name: 1-[2-[4-(4-methoxyphenyl)piperazin-1-yl]-1-methyl-ethyl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one CAS Name: 1-[1-[4-(4-methoxyphenyl)-1-piperazinyl]propan-2-yl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one IUPAC Name: 1-[1-[4-(4-methoxyphenyl)piperazin-1-yl]propan-2-yl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one Traditional Name: 1-[2-[4-(4-methoxyphenyl)piperazino]-1-methyl-ethyl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one Formula: C28H33N4O2+ MolecularWeight: 457.58722

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1CCN(CC1)C2=CC=C(C=C2)OC)[N+]3(CNC(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

CC(CN1CCN(CC1)C2=CC=C(C=C2)OC)[N+]3(CNC(=O)C4=CC=CC=C43)C5=CC=CC=C5

InChI

InChI=1S/C28H32N4O2/c1-22(20-30-16-18-31(19-17-30)23-12-14-25(34-2)15-13-23)32(24-8-4-3-5-9-24)21-29-28(33)26-10-6-7-11-27(26)32/h3-15,22H,16-21H2,1-2H3/p+1