1-cyanoethyl 4-(4-nonoxyphenyl)benzoate

Systemtic Name: 1-cyanoethyl 4-(4-nonoxyphenyl)benzoate Openeye Name: 1-cyanoethyl 4-(4-nonoxyphenyl)benzoate CAS Name: 4-(4-nonoxyphenyl)benzoic acid 1-cyanoethyl ester IUPAC Name: 1-cyanoethyl 4-(4-nonoxyphenyl)benzoate Traditional Name: 4-(4-nonoxyphenyl)benzoic acid 1-cyanoethyl ester Formula: C25H31NO3 MolecularWeight: 393.51854

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)C#N

Isomeric SMILES

CCCCCCCCCOC1=CC=C(C=C1)C2=CC=C(C=C2)C(=O)OC(C)C#N

InChI

InChI=1S/C25H31NO3/c1-3-4-5-6-7-8-9-18-28-24-16-14-22(15-17-24)21-10-12-23(13-11-21)25(27)29-20(2)19-26/h10-17,20H,3-9,18H2,1-2H3