diethyl 6-[bis(6-methoxyazulen-1-yl)methyl]azulene-1,3-dicarboxylate

Systemtic Name: diethyl 6-[bis(6-methoxyazulen-1-yl)methyl]azulene-1,3-dicarboxylate Openeye Name: diethyl 6-[bis(6-methoxyazulen-1-yl)methyl]azulene-1,3-dicarboxylate CAS Name: 6-[bis(6-methoxy-1-azulenyl)methyl]azulene-1,3-dicarboxylic acid diethyl ester IUPAC Name: diethyl 6-[bis(6-methoxyazulen-1-yl)methyl]azulene-1,3-dicarboxylate Traditional Name: 6-[bis(6-methoxyazulen-1-yl)methyl]azulene-1,3-dicarboxylic acid diethyl ester Formula: C39H34O6 MolecularWeight: 598.68366

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C2C1=CC=C(C=C2)C(C3=C4C=CC(=CC=C4C=C3)OC)C5=C6C=CC(=CC=C6C=C5)OC)C(=O)OCC

Isomeric SMILES

CCOC(=O)C1=CC(=C2C1=CC=C(C=C2)C(C3=C4C=CC(=CC=C4C=C3)OC)C5=C6C=CC(=CC=C6C=C5)OC)C(=O)OCC

InChI

InChI=1S/C39H34O6/c1-5-44-38(40)35-23-36(39(41)45-6-2)32-18-12-26(11-17-31(32)35)37(33-19-9-24-7-13-27(42-3)15-21-29(24)33)34-20-10-25-8-14-28(43-4)16-22-30(25)34/h7-23,37H,5-6H2,1-4H3