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

Systemtic Name: ethyl 2-(cycloheptylmethyl)-5-phenyl-1H-pyrrole-3-carboxylate Openeye Name: ethyl 2-(cycloheptylmethyl)-5-phenyl-1H-pyrrole-3-carboxylate CAS Name: 2-(cycloheptylmethyl)-5-phenyl-1H-pyrrole-3-carboxylic acid ethyl ester IUPAC Name: ethyl 2-(cycloheptylmethyl)-5-phenyl-1H-pyrrole-3-carboxylate Traditional Name: 2-(cycloheptylmethyl)-5-phenyl-1H-pyrrole-3-carboxylic acid ethyl ester Formula: C21H27NO2 MolecularWeight: 325.44458

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(NC(=C1)C2=CC=CC=C2)CC3CCCCCC3

Isomeric SMILES

CCOC(=O)C1=C(NC(=C1)C2=CC=CC=C2)CC3CCCCCC3

InChI

InChI=1S/C21H27NO2/c1-2-24-21(23)18-15-19(17-12-8-5-9-13-17)22-20(18)14-16-10-6-3-4-7-11-16/h5,8-9,12-13,15-16,22H,2-4,6-7,10-11,14H2,1H3