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

Systemtic Name: 1-[1-[4-(3-methoxyphenyl)piperazin-1-yl]propan-2-yl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one Openeye Name: 1-[2-[4-(3-methoxyphenyl)piperazin-1-yl]-1-methyl-ethyl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one CAS Name: 1-[1-[4-(3-methoxyphenyl)-1-piperazinyl]propan-2-yl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one IUPAC Name: 1-[1-[4-(3-methoxyphenyl)piperazin-1-yl]propan-2-yl]-1-phenyl-2,3-dihydroquinazolin-1-ium-4-one Traditional Name: 1-[2-[4-(3-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(=CC=C2)OC)[N+]3(CNC(=O)C4=CC=CC=C43)C5=CC=CC=C5

Isomeric SMILES

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

InChI

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