[2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] adamantane-1-carboxylate

Systemtic Name: [2-oxidanylidene-3-(1,3,3-trimethylindol-2-ylidene)propyl] adamantane-1-carboxylate Openeye Name: [2-oxo-3-(1,3,3-trimethylindolin-2-ylidene)propyl] adamantane-1-carboxylate CAS Name: 1-adamantanecarboxylic acid [2-oxo-3-(1,3,3-trimethyl-2-indolylidene)propyl] ester IUPAC Name: [2-oxo-3-(1,3,3-trimethylindol-2-ylidene)propyl] adamantane-1-carboxylate Traditional Name: adamantane-1-carboxylic acid [2-keto-3-(1,3,3-trimethylindolin-2-ylidene)propyl] ester Formula: C25H31NO3 MolecularWeight: 393.51854

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C2=CC=CC=C2N(C1=CC(=O)COC(=O)C34CC5CC(C3)CC(C5)C4)C)C

Isomeric SMILES

CC1(C2=CC=CC=C2N(C1=CC(=O)COC(=O)C34CC5CC(C3)CC(C5)C4)C)C

InChI

InChI=1S/C25H31NO3/c1-24(2)20-6-4-5-7-21(20)26(3)22(24)11-19(27)15-29-23(28)25-12-16-8-17(13-25)10-18(9-16)14-25/h4-7,11,16-18H,8-10,12-15H2,1-3H3