methyl 3-[7-chloranyl-2-[[(1-methylcyclopropyl)carbonylamino]methyl]-2,3-dihydro-1-benzofuran-5-yl]benzoate

Systemtic Name: methyl 3-[7-chloranyl-2-[[(1-methylcyclopropyl)carbonylamino]methyl]-2,3-dihydro-1-benzofuran-5-yl]benzoate Openeye Name: methyl 3-[7-chloro-2-[[(1-methylcyclopropanecarbonyl)amino]methyl]-2,3-dihydrobenzofuran-5-yl]benzoate CAS Name: 3-[7-chloro-2-[[[(1-methylcyclopropyl)-oxomethyl]amino]methyl]-2,3-dihydrobenzofuran-5-yl]benzoic acid methyl ester IUPAC Name: methyl 3-[7-chloro-2-[[(1-methylcyclopropanecarbonyl)amino]methyl]-2,3-dihydro-1-benzofuran-5-yl]benzoate Traditional Name: 3-[7-chloro-2-[[(1-methylcyclopropanecarbonyl)amino]methyl]coumaran-5-yl]benzoic acid methyl ester Formula: C22H22ClNO4 MolecularWeight: 399.86738

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CC1)C(=O)NCC2CC3=C(O2)C(=CC(=C3)C4=CC(=CC=C4)C(=O)OC)Cl

Isomeric SMILES

CC1(CC1)C(=O)NCC2CC3=C(O2)C(=CC(=C3)C4=CC(=CC=C4)C(=O)OC)Cl

InChI

InChI=1S/C22H22ClNO4/c1-22(6-7-22)21(26)24-12-17-10-16-9-15(11-18(23)19(16)28-17)13-4-3-5-14(8-13)20(25)27-2/h3-5,8-9,11,17H,6-7,10,12H2,1-2H3,(H,24,26)