[(2S)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 5-(4-ethanoylphenyl)furan-2-carboxylate

Systemtic Name: [(2S)-1-[(3-methylphenyl)amino]-1-oxidanylidene-propan-2-yl] 5-(4-ethanoylphenyl)furan-2-carboxylate Openeye Name: [(1S)-1-methyl-2-(3-methylanilino)-2-oxo-ethyl] 5-(4-acetylphenyl)furan-2-carboxylate CAS Name: 5-(4-acetylphenyl)-2-furancarboxylic acid [(2S)-1-(3-methylanilino)-1-oxopropan-2-yl] ester IUPAC Name: [(2S)-1-(3-methylanilino)-1-oxopropan-2-yl] 5-(4-acetylphenyl)furan-2-carboxylate Traditional Name: 5-(4-acetylphenyl)furan-2-carboxylic acid [(1S)-2-keto-1-methyl-2-(m-toluidino)ethyl] ester Formula: C23H21NO5 MolecularWeight: 391.41654

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)NC(=O)C(C)OC(=O)C2=CC=C(O2)C3=CC=C(C=C3)C(=O)C

Isomeric SMILES

CC1=CC(=CC=C1)NC(=O)[C@H](C)OC(=O)C2=CC=C(O2)C3=CC=C(C=C3)C(=O)C

InChI

InChI=1S/C23H21NO5/c1-14-5-4-6-19(13-14)24-22(26)16(3)28-23(27)21-12-11-20(29-21)18-9-7-17(8-10-18)15(2)25/h4-13,16H,1-3H3,(H,24,26)/t16-/m0/s1