[1-(1-ethoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-pentadecoxybenzoate

Systemtic Name: [1-(1-ethoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-pentadecoxybenzoate Openeye Name: [1-(1-ethoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] 4-pentadecoxybenzoate CAS Name: 4-pentadecoxybenzoic acid [1-(1-ethoxyethyl)-4-phenyl-1-cyclohexa-2,5-dienyl] ester IUPAC Name: [1-(1-ethoxyethyl)-4-phenylcyclohexa-2,5-dien-1-yl] 4-pentadecoxybenzoate Traditional Name: 4-pentadecoxybenzoic acid [1-(1-ethoxyethyl)-4-phenyl-cyclohexa-2,5-dien-1-yl] ester Formula: C38H54O4 MolecularWeight: 574.83296

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)C(C)OCC

Isomeric SMILES

CCCCCCCCCCCCCCCOC1=CC=C(C=C1)C(=O)OC2(C=CC(C=C2)C3=CC=CC=C3)C(C)OCC

InChI

InChI=1S/C38H54O4/c1-4-6-7-8-9-10-11-12-13-14-15-16-20-31-41-36-25-23-35(24-26-36)37(39)42-38(32(3)40-5-2)29-27-34(28-30-38)33-21-18-17-19-22-33/h17-19,21-30,32,34H,4-16,20,31H2,1-3H3