[(1R)-2-(1H-indol-3-yl)-2-oxidanylidene-1-phenyl-ethyl] adamantane-1-carboxylate

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

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)OC(C4=CC=CC=C4)C(=O)C5=CNC6=CC=CC=C65

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)O[C@H](C4=CC=CC=C4)C(=O)C5=CNC6=CC=CC=C65

InChI

InChI=1S/C27H27NO3/c29-24(22-16-28-23-9-5-4-8-21(22)23)25(20-6-2-1-3-7-20)31-26(30)27-13-17-10-18(14-27)12-19(11-17)15-27/h1-9,16-19,25,28H,10-15H2/t17?,18?,19?,25-,27?/m1/s1