ethyl 1-[3-(cyclohexylamino)-3-oxidanylidene-propyl]-5-(4-fluorophenyl)-2-methyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 1-[3-(cyclohexylamino)-3-oxidanylidene-propyl]-5-(4-fluorophenyl)-2-methyl-pyrrole-3-carboxylate Openeye Name: ethyl 1-[3-(cyclohexylamino)-3-oxo-propyl]-5-(4-fluorophenyl)-2-methyl-pyrrole-3-carboxylate CAS Name: 1-[3-(cyclohexylamino)-3-oxopropyl]-5-(4-fluorophenyl)-2-methyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[3-(cyclohexylamino)-3-oxopropyl]-5-(4-fluorophenyl)-2-methylpyrrole-3-carboxylate Traditional Name: 1-[3-(cyclohexylamino)-3-keto-propyl]-5-(4-fluorophenyl)-2-methyl-pyrrole-3-carboxylic acid ethyl ester Formula: C23H29FN2O3 MolecularWeight: 400.486363

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)F)CCC(=O)NC3CCCCC3)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1)C2=CC=C(C=C2)F)CCC(=O)NC3CCCCC3)C

InChI

InChI=1S/C23H29FN2O3/c1-3-29-23(28)20-15-21(17-9-11-18(24)12-10-17)26(16(20)2)14-13-22(27)25-19-7-5-4-6-8-19/h9-12,15,19H,3-8,13-14H2,1-2H3,(H,25,27)