[2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-phenyladamantane-1-carboxylate

Systemtic Name: [2-(1H-indol-3-yl)-2-oxidanylidene-ethyl] 3-phenyladamantane-1-carboxylate Openeye Name: [2-(1H-indol-3-yl)-2-oxo-ethyl] 3-phenyladamantane-1-carboxylate CAS Name: 3-phenyl-1-adamantanecarboxylic acid [2-(1H-indol-3-yl)-2-oxoethyl] ester IUPAC Name: [2-(1H-indol-3-yl)-2-oxoethyl] 3-phenyladamantane-1-carboxylate Traditional Name: 3-phenyladamantane-1-carboxylic acid [2-(1H-indol-3-yl)-2-keto-ethyl] ester Formula: C27H27NO3 MolecularWeight: 413.50818

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3(CC1CC(C2)(C3)C(=O)OCC(=O)C4=CNC5=CC=CC=C54)C6=CC=CC=C6

Isomeric SMILES

C1C2CC3(CC1CC(C2)(C3)C(=O)OCC(=O)C4=CNC5=CC=CC=C54)C6=CC=CC=C6

InChI

InChI=1S/C27H27NO3/c29-24(22-15-28-23-9-5-4-8-21(22)23)16-31-25(30)27-13-18-10-19(14-27)12-26(11-18,17-27)20-6-2-1-3-7-20/h1-9,15,18-19,28H,10-14,16-17H2