methyl 4-[[(2Z)-7-methyl-2-[(1-methylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxymethyl]benzoate

Systemtic Name: methyl 4-[[(2Z)-7-methyl-2-[(1-methylindol-3-yl)methylidene]-3-oxidanylidene-1-benzofuran-6-yl]oxymethyl]benzoate Openeye Name: methyl 4-[[(2Z)-7-methyl-2-[(1-methylindol-3-yl)methylene]-3-oxo-benzofuran-6-yl]oxymethyl]benzoate CAS Name: 4-[[(2Z)-7-methyl-2-[(1-methyl-3-indolyl)methylidene]-3-oxo-6-benzofuranyl]oxymethyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(2Z)-7-methyl-2-[(1-methylindol-3-yl)methylidene]-3-oxo-1-benzofuran-6-yl]oxymethyl]benzoate Traditional Name: 4-[[(2Z)-3-keto-7-methyl-2-[(1-methylindol-3-yl)methylene]coumaran-6-yl]oxymethyl]benzoic acid methyl ester Formula: C28H23NO5 MolecularWeight: 453.48592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC2=C1OC(=CC3=CN(C4=CC=CC=C43)C)C2=O)OCC5=CC=C(C=C5)C(=O)OC

Isomeric SMILES

CC1=C(C=CC2=C1O/C(=C\C3=CN(C4=CC=CC=C43)C)/C2=O)OCC5=CC=C(C=C5)C(=O)OC

InChI

InChI=1S/C28H23NO5/c1-17-24(33-16-18-8-10-19(11-9-18)28(31)32-3)13-12-22-26(30)25(34-27(17)22)14-20-15-29(2)23-7-5-4-6-21(20)23/h4-15H,16H2,1-3H3/b25-14-