methyl 4-[[7-[[methyl-(phenylmethyl)amino]methyl]-6-oxidanyl-3-oxidanylidene-1-benzofuran-2-ylidene]methyl]benzoate

Systemtic Name: methyl 4-[[7-[[methyl-(phenylmethyl)amino]methyl]-6-oxidanyl-3-oxidanylidene-1-benzofuran-2-ylidene]methyl]benzoate Openeye Name: methyl 4-[[7-[[benzyl(methyl)amino]methyl]-6-hydroxy-3-oxo-benzofuran-2-ylidene]methyl]benzoate CAS Name: 4-[[6-hydroxy-7-[[methyl-(phenylmethyl)amino]methyl]-3-oxo-2-benzofuranylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[7-[[benzyl(methyl)amino]methyl]-6-hydroxy-3-oxo-1-benzofuran-2-ylidene]methyl]benzoate Traditional Name: 4-[[7-[[benzyl(methyl)amino]methyl]-6-hydroxy-3-keto-coumaran-2-ylidene]methyl]benzoic acid methyl ester Formula: C26H23NO5 MolecularWeight: 429.46452

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=CC=C1)CC2=C(C=CC3=C2OC(=CC4=CC=C(C=C4)C(=O)OC)C3=O)O

Isomeric SMILES

CN(CC1=CC=CC=C1)CC2=C(C=CC3=C2OC(=CC4=CC=C(C=C4)C(=O)OC)C3=O)O

InChI

InChI=1S/C26H23NO5/c1-27(15-18-6-4-3-5-7-18)16-21-22(28)13-12-20-24(29)23(32-25(20)21)14-17-8-10-19(11-9-17)26(30)31-2/h3-14,28H,15-16H2,1-2H3