[1-[(4-methoxyphenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl] 5-chloranyl-2,3-dihydro-1-benzofuran-2-carboxylate

Systemtic Name: [1-[(4-methoxyphenyl)amino]-3-methyl-1-oxidanylidene-butan-2-yl] 5-chloranyl-2,3-dihydro-1-benzofuran-2-carboxylate Openeye Name: [1-[(4-methoxyphenyl)carbamoyl]-2-methyl-propyl] 5-chloro-2,3-dihydrobenzofuran-2-carboxylate CAS Name: 5-chloro-2,3-dihydrobenzofuran-2-carboxylic acid [1-(4-methoxyanilino)-3-methyl-1-oxobutan-2-yl] ester IUPAC Name: [1-(4-methoxyanilino)-3-methyl-1-oxobutan-2-yl] 5-chloro-2,3-dihydro-1-benzofuran-2-carboxylate Traditional Name: 5-chlorocoumaran-2-carboxylic acid [1-[(4-methoxyphenyl)carbamoyl]-2-methyl-propyl] ester Formula: C21H22ClNO5 MolecularWeight: 403.85608

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC1=CC=C(C=C1)OC)OC(=O)C2CC3=C(O2)C=CC(=C3)Cl

Isomeric SMILES

CC(C)C(C(=O)NC1=CC=C(C=C1)OC)OC(=O)C2CC3=C(O2)C=CC(=C3)Cl

InChI

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