4-phenyl-3-[1-(phenylmethyl)piperidin-4-yl]-1,4,4a,5,8,8a-hexahydroquinazolin-2-one

Systemtic Name: 4-phenyl-3-[1-(phenylmethyl)piperidin-4-yl]-1,4,4a,5,8,8a-hexahydroquinazolin-2-one Openeye Name: 3-(1-benzyl-4-piperidyl)-4-phenyl-1,4,4a,5,8,8a-hexahydroquinazolin-2-one CAS Name: 4-phenyl-3-[1-(phenylmethyl)-4-piperidinyl]-1,4,4a,5,8,8a-hexahydroquinazolin-2-one IUPAC Name: 3-(1-benzylpiperidin-4-yl)-4-phenyl-1,4,4a,5,8,8a-hexahydroquinazolin-2-one Traditional Name: 3-(1-benzyl-4-piperidyl)-4-phenyl-1,4,4a,5,8,8a-hexahydroquinazolin-2-one Formula: C26H31N3O MolecularWeight: 401.54384

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C(C3CC=CCC3NC2=O)C4=CC=CC=C4)CC5=CC=CC=C5

Isomeric SMILES

C1CN(CCC1N2C(C3CC=CCC3NC2=O)C4=CC=CC=C4)CC5=CC=CC=C5

InChI

InChI=1S/C26H31N3O/c30-26-27-24-14-8-7-13-23(24)25(21-11-5-2-6-12-21)29(26)22-15-17-28(18-16-22)19-20-9-3-1-4-10-20/h1-12,22-25H,13-19H2,(H,27,30)