dimethyl 4-(cyclohexylmethyl)-3,6-bis(hept-5-ynyl)benzene-1,2-dicarboxylate

Systemtic Name: dimethyl 4-(cyclohexylmethyl)-3,6-bis(hept-5-ynyl)benzene-1,2-dicarboxylate Openeye Name: dimethyl 4-(cyclohexylmethyl)-3,6-bis(hept-5-ynyl)benzene-1,2-dicarboxylate CAS Name: 4-(cyclohexylmethyl)-3,6-bis(hept-5-ynyl)benzene-1,2-dicarboxylic acid dimethyl ester IUPAC Name: dimethyl 4-(cyclohexylmethyl)-3,6-bis(hept-5-ynyl)benzene-1,2-dicarboxylate Traditional Name: 4-(cyclohexylmethyl)-3,6-bis(hept-5-ynyl)benzene-1,2-dicarboxylic acid dimethyl ester Formula: C31H42O4 MolecularWeight: 478.66278

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Descriptors Computed from Structure

Canonical SMILES:

CC#CCCCCC1=CC(=C(C(=C1C(=O)OC)C(=O)OC)CCCCC#CC)CC2CCCCC2

Isomeric SMILES

CC#CCCCCC1=CC(=C(C(=C1C(=O)OC)C(=O)OC)CCCCC#CC)CC2CCCCC2

InChI

InChI=1S/C31H42O4/c1-5-7-9-11-16-20-25-23-26(22-24-18-14-13-15-19-24)27(21-17-12-10-8-6-2)29(31(33)35-4)28(25)30(32)34-3/h23-24H,9-22H2,1-4H3