ethyl 3-[(2-chloranylpyridin-4-yl)carbonylamino]-4-(3-fluorophenyl)-1-methyl-pyrrole-2-carboxylate

Systemtic Name: ethyl 3-[(2-chloranylpyridin-4-yl)carbonylamino]-4-(3-fluorophenyl)-1-methyl-pyrrole-2-carboxylate Openeye Name: ethyl 3-[(2-chloropyridine-4-carbonyl)amino]-4-(3-fluorophenyl)-1-methyl-pyrrole-2-carboxylate CAS Name: 3-[[(2-chloro-4-pyridinyl)-oxomethyl]amino]-4-(3-fluorophenyl)-1-methyl-2-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(2-chloropyridine-4-carbonyl)amino]-4-(3-fluorophenyl)-1-methylpyrrole-2-carboxylate Traditional Name: 3-[(2-chloroisonicotinoyl)amino]-4-(3-fluorophenyl)-1-methyl-pyrrole-2-carboxylic acid ethyl ester Formula: C20H17ClFN3O3 MolecularWeight: 401.818683

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=CN1C)C2=CC(=CC=C2)F)NC(=O)C3=CC(=NC=C3)Cl

Isomeric SMILES

CCOC(=O)C1=C(C(=CN1C)C2=CC(=CC=C2)F)NC(=O)C3=CC(=NC=C3)Cl

InChI

InChI=1S/C20H17ClFN3O3/c1-3-28-20(27)18-17(24-19(26)13-7-8-23-16(21)10-13)15(11-25(18)2)12-5-4-6-14(22)9-12/h4-11H,3H2,1-2H3,(H,24,26)