diethyl 4-phenyl-1,4-dihydroazulene-1,3-dicarboxylate

Systemtic Name: diethyl 4-phenyl-1,4-dihydroazulene-1,3-dicarboxylate Openeye Name: diethyl 4-phenyl-1,4-dihydroazulene-1,3-dicarboxylate CAS Name: 4-phenyl-1,4-dihydroazulene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 4-phenyl-1,4-dihydroazulene-1,3-dicarboxylate Traditional Name: 4-phenyl-1,4-dihydroazulene-1,3-dicarboxylic acid diethyl ester Formula: C22H22O4 MolecularWeight: 350.40768

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1C=C(C2=C1C=CC=CC2C3=CC=CC=C3)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1C=C(C2=C1C=CC=CC2C3=CC=CC=C3)C(=O)OCC

InChI

InChI=1S/C22H22O4/c1-3-25-21(23)18-14-19(22(24)26-4-2)20-16(12-8-9-13-17(18)20)15-10-6-5-7-11-15/h5-14,16,18H,3-4H2,1-2H3