(3S)-2-(1-adamantyl)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]-3H-isoindol-1-one

Systemtic Name: (3S)-2-(1-adamantyl)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]-3H-isoindol-1-one Openeye Name: (3S)-2-(1-adamantyl)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]isoindolin-1-one CAS Name: (3S)-2-(1-adamantyl)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]-3H-isoindol-1-one IUPAC Name: (3S)-2-(1-adamantyl)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]-3H-isoindol-1-one Traditional Name: (3S)-2-(1-adamantyl)-3-[2-(2,5-dimethoxyphenyl)-1H-indol-3-yl]isoindolin-1-one Formula: C34H34N2O3 MolecularWeight: 518.64536

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C2=C(C3=CC=CC=C3N2)C4C5=CC=CC=C5C(=O)N4C67CC8CC(C6)CC(C8)C7

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C2=C(C3=CC=CC=C3N2)[C@@H]4C5=CC=CC=C5C(=O)N4C67CC8CC(C6)CC(C8)C7

InChI

InChI=1S/C34H34N2O3/c1-38-23-11-12-29(39-2)27(16-23)31-30(26-9-5-6-10-28(26)35-31)32-24-7-3-4-8-25(24)33(37)36(32)34-17-20-13-21(18-34)15-22(14-20)19-34/h3-12,16,20-22,32,35H,13-15,17-19H2,1-2H3/t20?,21?,22?,32-,34?/m0/s1