6-methoxy-9-methyl-3-(phenylmethyl)-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]isoindole

Systemtic Name: 6-methoxy-9-methyl-3-(phenylmethyl)-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]isoindole Openeye Name: 3-benzyl-6-methoxy-9-methyl-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]isoindole CAS Name: 6-methoxy-9-methyl-3-(phenylmethyl)-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]isoindole IUPAC Name: 3-benzyl-6-methoxy-9-methyl-2,3,3a,4,5,9b-hexahydro-1H-benzo[e]isoindole Traditional Name: 3-benzyl-6-methoxy-9-methyl-2,3,3a,4,5,9b-hexahydro-1H-benz[e]isoindole Formula: C21H25NO MolecularWeight: 307.4293

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C3CNC(C3CCC2=C(C=C1)OC)CC4=CC=CC=C4

Isomeric SMILES

CC1=C2C3CNC(C3CCC2=C(C=C1)OC)CC4=CC=CC=C4

InChI

InChI=1S/C21H25NO/c1-14-8-11-20(23-2)17-10-9-16-18(21(14)17)13-22-19(16)12-15-6-4-3-5-7-15/h3-8,11,16,18-19,22H,9-10,12-13H2,1-2H3