[4-[(3-methylphenyl)carbonylamino]phenyl] (2R)-5-chloranyl-2,3-dihydro-1-benzofuran-2-carboxylate

Systemtic Name: [4-[(3-methylphenyl)carbonylamino]phenyl] (2R)-5-chloranyl-2,3-dihydro-1-benzofuran-2-carboxylate Openeye Name: [4-[(3-methylbenzoyl)amino]phenyl] (2R)-5-chloro-2,3-dihydrobenzofuran-2-carboxylate CAS Name: (2R)-5-chloro-2,3-dihydrobenzofuran-2-carboxylic acid [4-[[(3-methylphenyl)-oxomethyl]amino]phenyl] ester IUPAC Name: [4-[(3-methylbenzoyl)amino]phenyl] (2R)-5-chloro-2,3-dihydro-1-benzofuran-2-carboxylate Traditional Name: (2R)-5-chlorocoumaran-2-carboxylic acid [4-(m-toluoylamino)phenyl] ester Formula: C23H18ClNO4 MolecularWeight: 407.84632

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)OC(=O)C3CC4=C(O3)C=CC(=C4)Cl

Isomeric SMILES

CC1=CC=CC(=C1)C(=O)NC2=CC=C(C=C2)OC(=O)[C@H]3CC4=C(O3)C=CC(=C4)Cl

InChI

InChI=1S/C23H18ClNO4/c1-14-3-2-4-15(11-14)22(26)25-18-6-8-19(9-7-18)28-23(27)21-13-16-12-17(24)5-10-20(16)29-21/h2-12,21H,13H2,1H3,(H,25,26)/t21-/m1/s1