7,7-dimethyl-3-(phenylmethyl)-1-propyl-2,4,6,8-tetrahydroquinazolin-5-one; hydron; chloride

Systemtic Name: 7,7-dimethyl-3-(phenylmethyl)-1-propyl-2,4,6,8-tetrahydroquinazolin-5-one; hydron; chloride Openeye Name: 3-benzyl-7,7-dimethyl-1-propyl-2,4,6,8-tetrahydroquinazolin-5-one; hydron; chloride CAS Name: 7,7-dimethyl-3-(phenylmethyl)-1-propyl-2,4,6,8-tetrahydroquinazolin-5-one; hydron; chloride IUPAC Name: 3-benzyl-7,7-dimethyl-1-propyl-2,4,6,8-tetrahydroquinazolin-5-one; hydron; chloride Traditional Name: 3-benzyl-7,7-dimethyl-1-propyl-2,4,6,8-tetrahydroquinazolin-5-one; hydron; chloride Formula: C20H29ClN2O MolecularWeight: 348.91006

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

[H+].CCCN1CN(CC2=C1CC(CC2=O)(C)C)CC3=CC=CC=C3.[Cl-]

Isomeric SMILES

[H+].CCCN1CN(CC2=C1CC(CC2=O)(C)C)CC3=CC=CC=C3.[Cl-]

InChI

InChI=1S/C20H28N2O.ClH/c1-4-10-22-15-21(13-16-8-6-5-7-9-16)14-17-18(22)11-20(2,3)12-19(17)23;/h5-9H,4,10-15H2,1-3H3;1H