1-(1-adamantyl)-3,3-bis(pyridin-4-ylmethyl)indol-2-one

Systemtic Name: 1-(1-adamantyl)-3,3-bis(pyridin-4-ylmethyl)indol-2-one Openeye Name: 1-(1-adamantyl)-3,3-bis(4-pyridylmethyl)indolin-2-one CAS Name: 1-(1-adamantyl)-3,3-bis(pyridin-4-ylmethyl)-2-indolone IUPAC Name: 1-(1-adamantyl)-3,3-bis(pyridin-4-ylmethyl)indol-2-one Traditional Name: 1-(1-adamantyl)-3,3-bis(4-pyridylmethyl)oxindole Formula: C30H31N3O MolecularWeight: 449.58664

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)N4C5=CC=CC=C5C(C4=O)(CC6=CC=NC=C6)CC7=CC=NC=C7

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)N4C5=CC=CC=C5C(C4=O)(CC6=CC=NC=C6)CC7=CC=NC=C7

InChI

InChI=1S/C30H31N3O/c34-28-30(19-21-5-9-31-10-6-21,20-22-7-11-32-12-8-22)26-3-1-2-4-27(26)33(28)29-16-23-13-24(17-29)15-25(14-23)18-29/h1-12,23-25H,13-20H2