[2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(methoxymethyl)-1-benzofuran-2-carboxylate

Systemtic Name: [2-[(4-chlorophenyl)methylamino]-2-oxidanylidene-ethyl] 3-(methoxymethyl)-1-benzofuran-2-carboxylate Openeye Name: [2-[(4-chlorophenyl)methylamino]-2-oxo-ethyl] 3-(methoxymethyl)benzofuran-2-carboxylate CAS Name: 3-(methoxymethyl)-2-benzofurancarboxylic acid [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] ester IUPAC Name: [2-[(4-chlorophenyl)methylamino]-2-oxoethyl] 3-(methoxymethyl)-1-benzofuran-2-carboxylate Traditional Name: 3-(methoxymethyl)coumarilic acid [2-[(4-chlorobenzyl)amino]-2-keto-ethyl] ester Formula: C20H18ClNO5 MolecularWeight: 387.81362

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Descriptors Computed from Structure

Canonical SMILES:

COCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)NCC3=CC=C(C=C3)Cl

Isomeric SMILES

COCC1=C(OC2=CC=CC=C21)C(=O)OCC(=O)NCC3=CC=C(C=C3)Cl

InChI

InChI=1S/C20H18ClNO5/c1-25-11-16-15-4-2-3-5-17(15)27-19(16)20(24)26-12-18(23)22-10-13-6-8-14(21)9-7-13/h2-9H,10-12H2,1H3,(H,22,23)