1-[4-phenyl-3-(4-prop-1-en-2-ylcyclohexen-1-yl)phenoxy]decyl benzoate

Systemtic Name: 1-[4-phenyl-3-(4-prop-1-en-2-ylcyclohexen-1-yl)phenoxy]decyl benzoate Openeye Name: 1-[3-(4-isopropenylcyclohexen-1-yl)-4-phenyl-phenoxy]decyl benzoate CAS Name: benzoic acid 1-[3-[4-(1-methylethenyl)-1-cyclohexenyl]-4-phenylphenoxy]decyl ester IUPAC Name: 1-[4-phenyl-3-(4-prop-1-en-2-ylcyclohexen-1-yl)phenoxy]decyl benzoate Traditional Name: benzoic acid 1-[3-(4-isopropenylcyclohexen-1-yl)-4-phenyl-phenoxy]decyl ester Formula: C38H46O3 MolecularWeight: 550.77004

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCC(OC1=CC(=C(C=C1)C2=CC=CC=C2)C3=CCC(CC3)C(=C)C)OC(=O)C4=CC=CC=C4

Isomeric SMILES

CCCCCCCCCC(OC1=CC(=C(C=C1)C2=CC=CC=C2)C3=CCC(CC3)C(=C)C)OC(=O)C4=CC=CC=C4

InChI

InChI=1S/C38H46O3/c1-4-5-6-7-8-9-16-21-37(41-38(39)33-19-14-11-15-20-33)40-34-26-27-35(31-17-12-10-13-18-31)36(28-34)32-24-22-30(23-25-32)29(2)3/h10-15,17-20,24,26-28,30,37H,2,4-9,16,21-23,25H2,1,3H3