3-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)carbonyl-2,3-dimethyl-4-piperidin-1-yl-tridecanenitrile

Systemtic Name: 3-(3,4-dimethoxyphenyl)-5-(4-fluorophenyl)carbonyl-2,3-dimethyl-4-piperidin-1-yl-tridecanenitrile Openeye Name: 3-(3,4-dimethoxyphenyl)-5-(4-fluorobenzoyl)-2,3-dimethyl-4-(1-piperidyl)tridecanenitrile CAS Name: 3-(3,4-dimethoxyphenyl)-5-[(4-fluorophenyl)-oxomethyl]-2,3-dimethyl-4-(1-piperidinyl)tridecanenitrile IUPAC Name: 3-(3,4-dimethoxyphenyl)-5-(4-fluorobenzoyl)-2,3-dimethyl-4-piperidin-1-yltridecanenitrile Traditional Name: 3-(3,4-dimethoxyphenyl)-5-(4-fluorobenzoyl)-2,3-dimethyl-4-piperidino-tridecanenitrile Formula: C35H49FN2O3 MolecularWeight: 564.773563

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCC(C(C(C)(C1=CC(=C(C=C1)OC)OC)C(C)C#N)N2CCCCC2)C(=O)C3=CC=C(C=C3)F

Isomeric SMILES

CCCCCCCCC(C(C(C)(C1=CC(=C(C=C1)OC)OC)C(C)C#N)N2CCCCC2)C(=O)C3=CC=C(C=C3)F

InChI

InChI=1S/C35H49FN2O3/c1-6-7-8-9-10-12-15-30(33(39)27-16-19-29(36)20-17-27)34(38-22-13-11-14-23-38)35(3,26(2)25-37)28-18-21-31(40-4)32(24-28)41-5/h16-21,24,26,30,34H,6-15,22-23H2,1-5H3