[1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 2,5-dimethylfuran-3-carboxylate

Systemtic Name: [1-[(4-chlorophenyl)methylamino]-1-oxidanylidene-propan-2-yl] 2,5-dimethylfuran-3-carboxylate Openeye Name: [2-[(4-chlorophenyl)methylamino]-1-methyl-2-oxo-ethyl] 2,5-dimethylfuran-3-carboxylate CAS Name: 2,5-dimethyl-3-furancarboxylic acid [1-[(4-chlorophenyl)methylamino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(4-chlorophenyl)methylamino]-1-oxopropan-2-yl] 2,5-dimethylfuran-3-carboxylate Traditional Name: 2,5-dimethylfuran-3-carboxylic acid [2-[(4-chlorobenzyl)amino]-2-keto-1-methyl-ethyl] ester Formula: C17H18ClNO4 MolecularWeight: 335.78212

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(O1)C)C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)Cl

Isomeric SMILES

CC1=CC(=C(O1)C)C(=O)OC(C)C(=O)NCC2=CC=C(C=C2)Cl

InChI

InChI=1S/C17H18ClNO4/c1-10-8-15(11(2)22-10)17(21)23-12(3)16(20)19-9-13-4-6-14(18)7-5-13/h4-8,12H,9H2,1-3H3,(H,19,20)