methyl 4-[(3-methoxyphenyl)carbonylamino]-2-methyl-5-oxidanylidene-1-(phenylmethyl)-4-(trifluoromethyl)pyrrole-3-carboxylate

Systemtic Name: methyl 4-[(3-methoxyphenyl)carbonylamino]-2-methyl-5-oxidanylidene-1-(phenylmethyl)-4-(trifluoromethyl)pyrrole-3-carboxylate Openeye Name: methyl 1-benzyl-4-[(3-methoxybenzoyl)amino]-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate CAS Name: 4-[[(3-methoxyphenyl)-oxomethyl]amino]-2-methyl-5-oxo-1-(phenylmethyl)-4-(trifluoromethyl)-3-pyrrolecarboxylic acid methyl ester IUPAC Name: methyl 1-benzyl-4-[(3-methoxybenzoyl)amino]-2-methyl-5-oxo-4-(trifluoromethyl)pyrrole-3-carboxylate Traditional Name: 1-benzyl-5-keto-4-(m-anisoylamino)-2-methyl-4-(trifluoromethyl)-2-pyrroline-3-carboxylic acid methyl ester Formula: C23H21F3N2O5 MolecularWeight: 462.41845

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(C(=O)N1CC2=CC=CC=C2)(C(F)(F)F)NC(=O)C3=CC(=CC=C3)OC)C(=O)OC

Isomeric SMILES

CC1=C(C(C(=O)N1CC2=CC=CC=C2)(C(F)(F)F)NC(=O)C3=CC(=CC=C3)OC)C(=O)OC

InChI

InChI=1S/C23H21F3N2O5/c1-14-18(20(30)33-3)22(23(24,25)26,21(31)28(14)13-15-8-5-4-6-9-15)27-19(29)16-10-7-11-17(12-16)32-2/h4-12H,13H2,1-3H3,(H,27,29)