ethyl 3-[[(3-azanyl-3-oxidanylidene-propyl)-(4-methoxyphenyl)amino]methyl]-1-benzofuran-2-carboxylate

Systemtic Name: ethyl 3-[[(3-azanyl-3-oxidanylidene-propyl)-(4-methoxyphenyl)amino]methyl]-1-benzofuran-2-carboxylate Openeye Name: ethyl 3-[(N-(3-amino-3-oxo-propyl)-4-methoxy-anilino)methyl]benzofuran-2-carboxylate CAS Name: 3-[(N-(3-amino-3-oxopropyl)-4-methoxyanilino)methyl]-2-benzofurancarboxylic acid ethyl ester IUPAC Name: ethyl 3-[(N-(3-amino-3-oxopropyl)-4-methoxyanilino)methyl]-1-benzofuran-2-carboxylate Traditional Name: 3-[(N-(3-amino-3-keto-propyl)-4-methoxy-anilino)methyl]coumarilic acid ethyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=CC=CC=C2O1)CN(CCC(=O)N)C3=CC=C(C=C3)OC

Isomeric SMILES

CCOC(=O)C1=C(C2=CC=CC=C2O1)CN(CCC(=O)N)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H24N2O5/c1-3-28-22(26)21-18(17-6-4-5-7-19(17)29-21)14-24(13-12-20(23)25)15-8-10-16(27-2)11-9-15/h4-11H,3,12-14H2,1-2H3,(H2,23,25)