ethyl 3-(cyclopentylcarbonylamino)-4-(3-fluorophenyl)-1-(phenylmethyl)pyrrole-2-carboxylate

Systemtic Name: ethyl 3-(cyclopentylcarbonylamino)-4-(3-fluorophenyl)-1-(phenylmethyl)pyrrole-2-carboxylate Openeye Name: ethyl 1-benzyl-3-(cyclopentanecarbonylamino)-4-(3-fluorophenyl)pyrrole-2-carboxylate CAS Name: 3-[[cyclopentyl(oxo)methyl]amino]-4-(3-fluorophenyl)-1-(phenylmethyl)-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 1-benzyl-3-(cyclopentanecarbonylamino)-4-(3-fluorophenyl)pyrrole-2-carboxylate Traditional Name: 1-benzyl-3-(cyclopentanecarbonylamino)-4-(3-fluorophenyl)pyrrole-2-carboxylic acid ethyl ester Formula: C26H27FN2O3 MolecularWeight: 434.502583

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC(=CC=C3)F)NC(=O)C4CCCC4

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1CC2=CC=CC=C2)C3=CC(=CC=C3)F)NC(=O)C4CCCC4

InChI

InChI=1S/C26H27FN2O3/c1-2-32-26(31)24-23(28-25(30)19-11-6-7-12-19)22(20-13-8-14-21(27)15-20)17-29(24)16-18-9-4-3-5-10-18/h3-5,8-10,13-15,17,19H,2,6-7,11-12,16H2,1H3,(H,28,30)