(4-methyl-2-oxidanylidene-chromen-7-yl) (E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoate

Systemtic Name: (4-methyl-2-oxidanylidene-chromen-7-yl) (E)-3-(6-chloranyl-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoate Openeye Name: (4-methyl-2-oxo-chromen-7-yl) (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoate CAS Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)-2-propenoic acid (4-methyl-2-oxo-1-benzopyran-7-yl) ester IUPAC Name: (4-methyl-2-oxochromen-7-yl) (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)prop-2-enoate Traditional Name: (E)-3-(6-chloro-3,4-dihydro-2H-1,5-benzodioxepin-8-yl)acrylic acid (2-keto-4-methyl-chromen-7-yl) ester Formula: C22H17ClO6 MolecularWeight: 412.81978

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)C=CC3=CC4=C(C(=C3)Cl)OCCCO4

Isomeric SMILES

CC1=CC(=O)OC2=C1C=CC(=C2)OC(=O)/C=C/C3=CC4=C(C(=C3)Cl)OCCCO4

InChI

InChI=1S/C22H17ClO6/c1-13-9-21(25)29-18-12-15(4-5-16(13)18)28-20(24)6-3-14-10-17(23)22-19(11-14)26-7-2-8-27-22/h3-6,9-12H,2,7-8H2,1H3/b6-3+