diethyl 5-(2-methylpropyl)-2,3-diphenyl-cyclohexa-1,3-diene-1,4-dicarboxylate

Systemtic Name: diethyl 5-(2-methylpropyl)-2,3-diphenyl-cyclohexa-1,3-diene-1,4-dicarboxylate Openeye Name: diethyl 5-isobutyl-2,3-diphenyl-cyclohexa-1,3-diene-1,4-dicarboxylate CAS Name: 5-(2-methylpropyl)-2,3-diphenylcyclohexa-1,3-diene-1,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-(2-methylpropyl)-2,3-diphenylcyclohexa-1,3-diene-1,4-dicarboxylate Traditional Name: 5-isobutyl-2,3-diphenyl-cyclohexa-1,3-diene-1,4-dicarboxylic acid diethyl ester Formula: C28H32O4 MolecularWeight: 432.55128

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(C(C1)CC(C)C)C(=O)OCC)C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CCOC(=O)C1=C(C(=C(C(C1)CC(C)C)C(=O)OCC)C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H32O4/c1-5-31-27(29)23-18-22(17-19(3)4)26(28(30)32-6-2)25(21-15-11-8-12-16-21)24(23)20-13-9-7-10-14-20/h7-16,19,22H,5-6,17-18H2,1-4H3