ethyl 4-[2-[cyclohexyl-(4-fluorophenyl)carbonyl-amino]propanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 4-[2-[cyclohexyl-(4-fluorophenyl)carbonyl-amino]propanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate Openeye Name: ethyl 4-[2-[cyclohexyl-(4-fluorobenzoyl)amino]propanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylate CAS Name: 4-[2-[cyclohexyl-[(4-fluorophenyl)-oxomethyl]amino]-1-oxopropyl]-1-ethyl-3,5-dimethyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[2-[cyclohexyl-(4-fluorobenzoyl)amino]propanoyl]-1-ethyl-3,5-dimethylpyrrole-2-carboxylate Traditional Name: 4-[2-[cyclohexyl-(4-fluorobenzoyl)amino]propanoyl]-1-ethyl-3,5-dimethyl-pyrrole-2-carboxylic acid ethyl ester Formula: C27H35FN2O4 MolecularWeight: 470.576203

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Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)C(C)N(C2CCCCC2)C(=O)C3=CC=C(C=C3)F)C

Isomeric SMILES

CCN1C(=C(C(=C1C(=O)OCC)C)C(=O)C(C)N(C2CCCCC2)C(=O)C3=CC=C(C=C3)F)C

InChI

InChI=1S/C27H35FN2O4/c1-6-29-18(4)23(17(3)24(29)27(33)34-7-2)25(31)19(5)30(22-11-9-8-10-12-22)26(32)20-13-15-21(28)16-14-20/h13-16,19,22H,6-12H2,1-5H3