(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl 2-[(4-chlorophenyl)carbonylamino]ethanoate

Systemtic Name: (5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl 2-[(4-chlorophenyl)carbonylamino]ethanoate Openeye Name: (5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl 2-[(4-chlorobenzoyl)amino]acetate CAS Name: 2-[[(4-chlorophenyl)-oxomethyl]amino]acetic acid (5-ethoxy-2-methyl-2,3-dihydrobenzofuran-6-yl)methyl ester IUPAC Name: (5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)methyl 2-[(4-chlorobenzoyl)amino]acetate Traditional Name: 2-[(4-chlorobenzoyl)amino]acetic acid (5-ethoxy-2-methyl-coumaran-6-yl)methyl ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=C(C=C2C(=C1)CC(O2)C)COC(=O)CNC(=O)C3=CC=C(C=C3)Cl

Isomeric SMILES

CCOC1=C(C=C2C(=C1)CC(O2)C)COC(=O)CNC(=O)C3=CC=C(C=C3)Cl

InChI

InChI=1S/C21H22ClNO5/c1-3-26-18-9-15-8-13(2)28-19(15)10-16(18)12-27-20(24)11-23-21(25)14-4-6-17(22)7-5-14/h4-7,9-10,13H,3,8,11-12H2,1-2H3,(H,23,25)