dimethyl 1,1-diphenyl-8aH-azulene-4,5-dicarboxylate

Systemtic Name: dimethyl 1,1-diphenyl-8aH-azulene-4,5-dicarboxylate Openeye Name: dimethyl 1,1-diphenyl-8aH-azulene-4,5-dicarboxylate CAS Name: 1,1-diphenyl-8aH-azulene-4,5-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 1,1-diphenyl-8aH-azulene-4,5-dicarboxylate Traditional Name: 1,1-diphenyl-8aH-azulene-4,5-dicarboxylic acid dimethyl ester Formula: C26H22O4 MolecularWeight: 398.45048

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC2C(=C1C(=O)OC)C=CC2(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

COC(=O)C1=CC=CC2C(=C1C(=O)OC)C=CC2(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H22O4/c1-29-24(27)21-14-9-15-22-20(23(21)25(28)30-2)16-17-26(22,18-10-5-3-6-11-18)19-12-7-4-8-13-19/h3-17,22H,1-2H3