methyl 4-[(3E)-3-(2-ethoxy-2-oxidanylidene-ethylidene)hept-1-en-2-yl]benzoate

Systemtic Name: methyl 4-[(3E)-3-(2-ethoxy-2-oxidanylidene-ethylidene)hept-1-en-2-yl]benzoate Openeye Name: methyl 4-[(2E)-2-(2-ethoxy-2-oxo-ethylidene)-1-methylene-hexyl]benzoate CAS Name: 4-[(3E)-3-(2-ethoxy-2-oxoethylidene)hept-1-en-2-yl]benzoic acid methyl ester IUPAC Name: methyl 4-[(3E)-3-(2-ethoxy-2-oxoethylidene)hept-1-en-2-yl]benzoate Traditional Name: 4-[(E)-2-butyl-4-ethoxy-4-keto-1-methylene-but-2-enyl]benzoic acid methyl ester Formula: C19H24O4 MolecularWeight: 316.39146

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=CC(=O)OCC)C(=C)C1=CC=C(C=C1)C(=O)OC

Isomeric SMILES

CCCC/C(=C\C(=O)OCC)/C(=C)C1=CC=C(C=C1)C(=O)OC

InChI

InChI=1S/C19H24O4/c1-5-7-8-17(13-18(20)23-6-2)14(3)15-9-11-16(12-10-15)19(21)22-4/h9-13H,3,5-8H2,1-2,4H3/b17-13+