4-[1-(1-adamantylmethyl)-2-oxidanylidene-3H-indol-6-yl]benzenecarbonitrile

Systemtic Name: 4-[1-(1-adamantylmethyl)-2-oxidanylidene-3H-indol-6-yl]benzenecarbonitrile Openeye Name: 4-[1-(1-adamantylmethyl)-2-oxo-indolin-6-yl]benzonitrile CAS Name: 4-[1-(1-adamantylmethyl)-2-oxo-3H-indol-6-yl]benzonitrile IUPAC Name: 4-[1-(1-adamantylmethyl)-2-oxo-3H-indol-6-yl]benzonitrile Traditional Name: 4-[1-(1-adamantylmethyl)-2-keto-indolin-6-yl]benzonitrile Formula: C26H26N2O MolecularWeight: 382.49744

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)CN4C(=O)CC5=C4C=C(C=C5)C6=CC=C(C=C6)C#N

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)CN4C(=O)CC5=C4C=C(C=C5)C6=CC=C(C=C6)C#N

InChI

InChI=1S/C26H26N2O/c27-15-17-1-3-21(4-2-17)22-5-6-23-11-25(29)28(24(23)10-22)16-26-12-18-7-19(13-26)9-20(8-18)14-26/h1-6,10,18-20H,7-9,11-14,16H2