ethyl 2-(1-adamantylmethyl)-5-phenyl-1H-pyrrole-3-carboxylate

Systemtic Name: ethyl 2-(1-adamantylmethyl)-5-phenyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2-(1-adamantylmethyl)-5-phenyl-1H-pyrrole-3-carboxylate CAS Name: 2-(1-adamantylmethyl)-5-phenyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(1-adamantylmethyl)-5-phenyl-1H-pyrrole-3-carboxylate Traditional Name: 2-(1-adamantylmethyl)-5-phenyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C24H29NO2 MolecularWeight: 363.49256

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1)C2=CC=CC=C2)CC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1)C2=CC=CC=C2)CC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C24H29NO2/c1-2-27-23(26)20-11-21(19-6-4-3-5-7-19)25-22(20)15-24-12-16-8-17(13-24)10-18(9-16)14-24/h3-7,11,16-18,25H,2,8-10,12-15H2,1H3