3-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-4-phenyl-1,4-dihydroquinazolin-2-one

Systemtic Name: 3-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-4-phenyl-1,4-dihydroquinazolin-2-one Openeye Name: 3-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidyl]-4-phenyl-1,4-dihydroquinazolin-2-one CAS Name: 3-[1-(1,3-benzodioxol-5-ylmethyl)-4-piperidinyl]-4-phenyl-1,4-dihydroquinazolin-2-one IUPAC Name: 3-[1-(1,3-benzodioxol-5-ylmethyl)piperidin-4-yl]-4-phenyl-1,4-dihydroquinazolin-2-one Traditional Name: 4-phenyl-3-(1-piperonyl-4-piperidyl)-1,4-dihydroquinazolin-2-one Formula: C27H27N3O3 MolecularWeight: 441.52158

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(C3=CC=CC=C3NC2=O)C4=CC=CC=C4)CC5=CC6=C(C=C5)OCO6

Isomeric SMILES

C1CN(CCC1N2C(C3=CC=CC=C3NC2=O)C4=CC=CC=C4)CC5=CC6=C(C=C5)OCO6

InChI

InChI=1S/C27H27N3O3/c31-27-28-23-9-5-4-8-22(23)26(20-6-2-1-3-7-20)30(27)21-12-14-29(15-13-21)17-19-10-11-24-25(16-19)33-18-32-24/h1-11,16,21,26H,12-15,17-18H2,(H,28,31)