1-[2-(phenylmethyl)-4,5,6,7-tetrahydroisoindol-1-yl]pentan-1-one

Systemtic Name: 1-[2-(phenylmethyl)-4,5,6,7-tetrahydroisoindol-1-yl]pentan-1-one Openeye Name: 1-(2-benzyl-4,5,6,7-tetrahydroisoindol-1-yl)pentan-1-one CAS Name: 1-[2-(phenylmethyl)-4,5,6,7-tetrahydroisoindol-1-yl]-1-pentanone IUPAC Name: 1-(2-benzyl-4,5,6,7-tetrahydroisoindol-1-yl)pentan-1-one Traditional Name: 1-(2-benzyl-4,5,6,7-tetrahydroisoindol-1-yl)pentan-1-one Formula: C20H25NO MolecularWeight: 295.4186

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C1=C2CCCCC2=CN1CC3=CC=CC=C3

Isomeric SMILES

CCCCC(=O)C1=C2CCCCC2=CN1CC3=CC=CC=C3

InChI

InChI=1S/C20H25NO/c1-2-3-13-19(22)20-18-12-8-7-11-17(18)15-21(20)14-16-9-5-4-6-10-16/h4-6,9-10,15H,2-3,7-8,11-14H2,1H3