ethyl 5-(1-adamantylcarbonyloxy)-2-methyl-1-phenyl-indole-3-carboxylate

Systemtic Name: ethyl 5-(1-adamantylcarbonyloxy)-2-methyl-1-phenyl-indole-3-carboxylate Openeye Name: ethyl 5-(adamantane-1-carbonyloxy)-2-methyl-1-phenyl-indole-3-carboxylate CAS Name: 5-[1-adamantyl(oxo)methoxy]-2-methyl-1-phenyl-3-indolecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(adamantane-1-carbonyloxy)-2-methyl-1-phenylindole-3-carboxylate Traditional Name: 5-(adamantane-1-carbonyloxy)-2-methyl-1-phenyl-indole-3-carboxylic acid ethyl ester Formula: C29H31NO4 MolecularWeight: 457.56074

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6)C

Isomeric SMILES

CCOC(=O)C1=C(N(C2=C1C=C(C=C2)OC(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6)C

InChI

InChI=1S/C29H31NO4/c1-3-33-27(31)26-18(2)30(22-7-5-4-6-8-22)25-10-9-23(14-24(25)26)34-28(32)29-15-19-11-20(16-29)13-21(12-19)17-29/h4-10,14,19-21H,3,11-13,15-17H2,1-2H3