tert-butyl (E)-4-[[6-methoxy-3-methyl-5-oxidanyl-2-oxidanylidene-4-[(E)-prop-1-enyl]-1-benzofuran-3-yl]amino]-4-oxidanylidene-but-2-enoate

Systemtic Name: tert-butyl (E)-4-[[6-methoxy-3-methyl-5-oxidanyl-2-oxidanylidene-4-[(E)-prop-1-enyl]-1-benzofuran-3-yl]amino]-4-oxidanylidene-but-2-enoate Openeye Name: tert-butyl (E)-4-[[5-hydroxy-6-methoxy-3-methyl-2-oxo-4-[(E)-prop-1-enyl]benzofuran-3-yl]amino]-4-oxo-but-2-enoate CAS Name: (E)-4-[[5-hydroxy-6-methoxy-3-methyl-2-oxo-4-[(E)-prop-1-enyl]-3-benzofuranyl]amino]-4-oxo-2-butenoic acid tert-butyl ester IUPAC Name: tert-butyl (E)-4-[[5-hydroxy-6-methoxy-3-methyl-2-oxo-4-[(E)-prop-1-enyl]-1-benzofuran-3-yl]amino]-4-oxobut-2-enoate Traditional Name: (E)-4-[[5-hydroxy-2-keto-6-methoxy-3-methyl-4-[(E)-prop-1-enyl]coumaran-3-yl]amino]-4-keto-but-2-enoic acid tert-butyl ester Formula: C21H25NO7 MolecularWeight: 403.4257

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Descriptors Computed from Structure

Canonical SMILES:

CC=CC1=C2C(=CC(=C1O)OC)OC(=O)C2(C)NC(=O)C=CC(=O)OC(C)(C)C

Isomeric SMILES

C/C=C/C1=C2C(=CC(=C1O)OC)OC(=O)C2(C)NC(=O)/C=C/C(=O)OC(C)(C)C

InChI

InChI=1S/C21H25NO7/c1-7-8-12-17-13(11-14(27-6)18(12)25)28-19(26)21(17,5)22-15(23)9-10-16(24)29-20(2,3)4/h7-11,25H,1-6H3,(H,22,23)/b8-7+,10-9+