dimethyl (7E)-7-[(E)-3-phenylprop-2-enylidene]cyclohepta-1,3,5-triene-1,2-dicarboxylate

Systemtic Name: dimethyl (7E)-7-[(E)-3-phenylprop-2-enylidene]cyclohepta-1,3,5-triene-1,2-dicarboxylate Openeye Name: dimethyl (7E)-7-[(E)-3-phenylprop-2-enylidene]cyclohepta-1,3,5-triene-1,2-dicarboxylate CAS Name: (7E)-7-[(E)-3-phenylprop-2-enylidene]cyclohepta-1,3,5-triene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl (7E)-7-[(E)-3-phenylprop-2-enylidene]cyclohepta-1,3,5-triene-1,2-dicarboxylate Traditional Name: (7E)-7-[(E)-3-phenylprop-2-enylidene]cyclohepta-1,3,5-triene-1,2-dicarboxylic acid dimethyl ester Formula: C20H18O4 MolecularWeight: 322.35452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=C(C(=CC=CC2=CC=CC=C2)C=CC=C1)C(=O)OC

Isomeric SMILES

COC(=O)C1=C(/C(=C/C=C/C2=CC=CC=C2)/C=CC=C1)C(=O)OC

InChI

InChI=1S/C20H18O4/c1-23-19(21)17-14-7-6-12-16(18(17)20(22)24-2)13-8-11-15-9-4-3-5-10-15/h3-14H,1-2H3/b11-8+,16-13+