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

Systemtic Name: methyl 4-[(Z)-[7-(dimethylaminomethyl)-4-methyl-6-oxidanyl-3-oxidanylidene-1-benzofuran-2-ylidene]methyl]benzoate Openeye Name: methyl 4-[(Z)-[7-(dimethylaminomethyl)-6-hydroxy-4-methyl-3-oxo-benzofuran-2-ylidene]methyl]benzoate CAS Name: 4-[(Z)-[7-(dimethylaminomethyl)-6-hydroxy-4-methyl-3-oxo-2-benzofuranylidene]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[(Z)-[7-(dimethylaminomethyl)-6-hydroxy-4-methyl-3-oxo-1-benzofuran-2-ylidene]methyl]benzoate Traditional Name: 4-[(Z)-[7-(dimethylaminomethyl)-6-hydroxy-3-keto-4-methyl-coumaran-2-ylidene]methyl]benzoic acid methyl ester Formula: C21H21NO5 MolecularWeight: 367.39514

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C2=C1C(=O)C(=CC3=CC=C(C=C3)C(=O)OC)O2)CN(C)C)O

Isomeric SMILES

CC1=CC(=C(C2=C1C(=O)/C(=C/C3=CC=C(C=C3)C(=O)OC)/O2)CN(C)C)O

InChI

InChI=1S/C21H21NO5/c1-12-9-16(23)15(11-22(2)3)20-18(12)19(24)17(27-20)10-13-5-7-14(8-6-13)21(25)26-4/h5-10,23H,11H2,1-4H3/b17-10-