5-[(1S)-1-[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]ethyl]furan-2-carboxylate

Systemtic Name: 5-[(1S)-1-[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]ethyl]furan-2-carboxylate Openeye Name: 5-[(1S)-1-[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]ethyl]furan-2-carboxylate CAS Name: 5-[(1S)-1-[4-[(2,3-dimethylanilino)-oxomethyl]phenoxy]ethyl]-2-furancarboxylate IUPAC Name: 5-[(1S)-1-[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]ethyl]furan-2-carboxylate Traditional Name: 5-[(1S)-1-[4-[(2,3-dimethylphenyl)carbamoyl]phenoxy]ethyl]-2-furoate Formula: C22H20NO5- MolecularWeight: 378.3979

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)OC(C)C3=CC=C(O3)C(=O)[O-])C

Isomeric SMILES

CC1=C(C(=CC=C1)NC(=O)C2=CC=C(C=C2)O[C@@H](C)C3=CC=C(O3)C(=O)[O-])C

InChI

InChI=1S/C22H21NO5/c1-13-5-4-6-18(14(13)2)23-21(24)16-7-9-17(10-8-16)27-15(3)19-11-12-20(28-19)22(25)26/h4-12,15H,1-3H3,(H,23,24)(H,25,26)/p-1/t15-/m0/s1