methyl 5-(1-hydroxyethyl)-3-(methoxymethyl)cyclohepta-1,4-diene-1-carboxylate

Systemtic Name: methyl 5-(1-hydroxyethyl)-3-(methoxymethyl)cyclohepta-1,4-diene-1-carboxylate Openeye Name: methyl 5-(1-hydroxyethyl)-3-(methoxymethyl)cyclohepta-1,4-diene-1-carboxylate CAS Name: 5-(1-hydroxyethyl)-3-(methoxymethyl)-1-cyclohepta-1,4-dienecarboxylic acid methyl ester IUPAC Name: methyl 5-(1-hydroxyethyl)-3-(methoxymethyl)cyclohepta-1,4-diene-1-carboxylate Traditional Name: 5-(1-hydroxyethyl)-3-(methoxymethyl)cyclohepta-1,4-diene-1-carboxylic acid methyl ester Formula: C13H20O4 MolecularWeight: 240.2955

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC(C=C(CC1)C(=O)OC)COC)O

Isomeric SMILES

CC(C1=CC(C=C(CC1)C(=O)OC)COC)O

InChI

InChI=1S/C13H20O4/c1-9(14)11-4-5-12(13(15)17-3)7-10(6-11)8-16-2/h6-7,9-10,14H,4-5,8H2,1-3H3