[3-(2,5-dihydropyrrol-1-yl)-2-[(4-fluorophenyl)carbonylamino]cyclohexyl] propanoate

Systemtic Name: [3-(2,5-dihydropyrrol-1-yl)-2-[(4-fluorophenyl)carbonylamino]cyclohexyl] propanoate Openeye Name: [3-(2,5-dihydropyrrol-1-yl)-2-[(4-fluorobenzoyl)amino]cyclohexyl] propanoate CAS Name: propanoic acid [3-(2,5-dihydropyrrol-1-yl)-2-[[(4-fluorophenyl)-oxomethyl]amino]cyclohexyl] ester IUPAC Name: [3-(2,5-dihydropyrrol-1-yl)-2-[(4-fluorobenzoyl)amino]cyclohexyl] propanoate Traditional Name: propionic acid [2-[(4-fluorobenzoyl)amino]-3-(3-pyrrolin-1-yl)cyclohexyl] ester Formula: C20H25FN2O3 MolecularWeight: 360.422503

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)OC1CCCC(C1NC(=O)C2=CC=C(C=C2)F)N3CC=CC3

Isomeric SMILES

CCC(=O)OC1CCCC(C1NC(=O)C2=CC=C(C=C2)F)N3CC=CC3

InChI

InChI=1S/C20H25FN2O3/c1-2-18(24)26-17-7-5-6-16(23-12-3-4-13-23)19(17)22-20(25)14-8-10-15(21)11-9-14/h3-4,8-11,16-17,19H,2,5-7,12-13H2,1H3,(H,22,25)