2-(1-adamantyl)-3-(1,2-dimethylindol-3-yl)-4,5,6,7-tetrahydro-3H-isoindol-1-one

Systemtic Name: 2-(1-adamantyl)-3-(1,2-dimethylindol-3-yl)-4,5,6,7-tetrahydro-3H-isoindol-1-one Openeye Name: 2-(1-adamantyl)-3-(1,2-dimethylindol-3-yl)-4,5,6,7-tetrahydro-3H-isoindol-1-one CAS Name: 2-(1-adamantyl)-3-(1,2-dimethyl-3-indolyl)-4,5,6,7-tetrahydro-3H-isoindol-1-one IUPAC Name: 2-(1-adamantyl)-3-(1,2-dimethylindol-3-yl)-4,5,6,7-tetrahydro-3H-isoindol-1-one Traditional Name: 2-(1-adamantyl)-3-(1,2-dimethylindol-3-yl)-4,5,6,7-tetrahydro-3H-isoindol-1-one Formula: C28H34N2O MolecularWeight: 414.58236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)C3C4=C(CCCC4)C(=O)N3C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)C3C4=C(CCCC4)C(=O)N3C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C28H34N2O/c1-17-25(23-9-5-6-10-24(23)29(17)2)26-21-7-3-4-8-22(21)27(31)30(26)28-14-18-11-19(15-28)13-20(12-18)16-28/h5-6,9-10,18-20,26H,3-4,7-8,11-16H2,1-2H3