[2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-methyl-5-(3-oxidanylidenebutyl)-1-benzofuran-2-carboxylate

Systemtic Name: [2-[(2-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-methyl-5-(3-oxidanylidenebutyl)-1-benzofuran-2-carboxylate Openeye Name: [2-[(2-chlorophenyl)methylamino]-2-oxo-ethyl] 3-methyl-5-(3-oxobutyl)benzofuran-2-carboxylate CAS Name: 3-methyl-5-(3-oxobutyl)-2-benzofurancarboxylic acid [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(2-chlorophenyl)methylamino]-2-oxoethyl] 3-methyl-5-(3-oxobutyl)-1-benzofuran-2-carboxylate Traditional Name: 5-(3-ketobutyl)-3-methyl-coumarilic acid [2-[(2-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C23H22ClNO5 MolecularWeight: 427.87748

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(OC2=C1C=C(C=C2)CCC(=O)C)C(=O)OCC(=O)NCC3=CC=CC=C3Cl

Isomeric SMILES

CC1=C(OC2=C1C=C(C=C2)CCC(=O)C)C(=O)OCC(=O)NCC3=CC=CC=C3Cl

InChI

InChI=1S/C23H22ClNO5/c1-14(26)7-8-16-9-10-20-18(11-16)15(2)22(30-20)23(28)29-13-21(27)25-12-17-5-3-4-6-19(17)24/h3-6,9-11H,7-8,12-13H2,1-2H3,(H,25,27)