(3S)-2-(1-adamantyl)-3-(1,2-dimethylindol-3-yl)-3H-isoindol-1-one

Systemtic Name: (3S)-2-(1-adamantyl)-3-(1,2-dimethylindol-3-yl)-3H-isoindol-1-one Openeye Name: (3S)-2-(1-adamantyl)-3-(1,2-dimethylindol-3-yl)isoindolin-1-one CAS Name: (3S)-2-(1-adamantyl)-3-(1,2-dimethyl-3-indolyl)-3H-isoindol-1-one IUPAC Name: (3S)-2-(1-adamantyl)-3-(1,2-dimethylindol-3-yl)-3H-isoindol-1-one Traditional Name: (3S)-2-(1-adamantyl)-3-(1,2-dimethylindol-3-yl)isoindolin-1-one Formula: C28H30N2O MolecularWeight: 410.5506

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=CC=CC=C2N1C)C3C4=CC=CC=C4C(=O)N3C56CC7CC(C5)CC(C7)C6

Isomeric SMILES

CC1=C(C2=CC=CC=C2N1C)[C@@H]3C4=CC=CC=C4C(=O)N3C56CC7CC(C5)CC(C7)C6

InChI

InChI=1S/C28H30N2O/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/h3-10,18-20,26H,11-16H2,1-2H3/t18?,19?,20?,26-,28?/m0/s1