2-[(4aR,6R,8aS)-4a-(3-methoxyphenyl)-2,8a-dimethyl-3,4,5,6,7,8-hexahydro-1H-isoquinolin-6-yl]isoindole-1,3-dione

Systemtic Name: 2-[(4aR,6R,8aS)-4a-(3-methoxyphenyl)-2,8a-dimethyl-3,4,5,6,7,8-hexahydro-1H-isoquinolin-6-yl]isoindole-1,3-dione Openeye Name: 2-[(4aR,6R,8aS)-4a-(3-methoxyphenyl)-2,8a-dimethyl-3,4,5,6,7,8-hexahydro-1H-isoquinolin-6-yl]isoindoline-1,3-dione CAS Name: 2-[(4aR,6R,8aS)-4a-(3-methoxyphenyl)-2,8a-dimethyl-3,4,5,6,7,8-hexahydro-1H-isoquinolin-6-yl]isoindole-1,3-dione IUPAC Name: 2-[(4aR,6R,8aS)-4a-(3-methoxyphenyl)-2,8a-dimethyl-3,4,5,6,7,8-hexahydro-1H-isoquinolin-6-yl]isoindole-1,3-dione Traditional Name: 2-[(4aR,6R,8aS)-4a-(3-methoxyphenyl)-2,8a-dimethyl-3,4,5,6,7,8-hexahydro-1H-isoquinolin-6-yl]isoindoline-1,3-quinone Formula: C26H30N2O3 MolecularWeight: 418.528

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Descriptors Computed from Structure

Canonical SMILES:

CC12CCC(CC1(CCN(C2)C)C3=CC(=CC=C3)OC)N4C(=O)C5=CC=CC=C5C4=O

Isomeric SMILES

C[C@]12CC[C@H](C[C@]1(CCN(C2)C)C3=CC(=CC=C3)OC)N4C(=O)C5=CC=CC=C5C4=O

InChI

InChI=1S/C26H30N2O3/c1-25-12-11-19(28-23(29)21-9-4-5-10-22(21)24(28)30)16-26(25,13-14-27(2)17-25)18-7-6-8-20(15-18)31-3/h4-10,15,19H,11-14,16-17H2,1-3H3/t19-,25-,26-/m1/s1