methyl 4-chloranyl-3-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]ethanoylamino]benzoate

Systemtic Name: methyl 4-chloranyl-3-[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]ethanoylamino]benzoate Openeye Name: methyl 4-chloro-3-[[2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]acetyl]amino]benzoate CAS Name: 4-chloro-3-[[2-[(2,2-dimethyl-3H-benzofuran-7-yl)oxy]-1-oxoethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 4-chloro-3-[[2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetyl]amino]benzoate Traditional Name: 4-chloro-3-[[2-(2,2-dimethylcoumaran-7-yl)oxyacetyl]amino]benzoic acid methyl ester Formula: C20H20ClNO5 MolecularWeight: 389.8295

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)NC3=C(C=CC(=C3)C(=O)OC)Cl)C

Isomeric SMILES

CC1(CC2=C(O1)C(=CC=C2)OCC(=O)NC3=C(C=CC(=C3)C(=O)OC)Cl)C

InChI

InChI=1S/C20H20ClNO5/c1-20(2)10-13-5-4-6-16(18(13)27-20)26-11-17(23)22-15-9-12(19(24)25-3)7-8-14(15)21/h4-9H,10-11H2,1-3H3,(H,22,23)