4-[3-(4-tert-butylphenoxy)propyl-(cyclopropylmethyl)amino]-2-(trifluoromethyl)benzenecarbonitrile

Systemtic Name: 4-[3-(4-tert-butylphenoxy)propyl-(cyclopropylmethyl)amino]-2-(trifluoromethyl)benzenecarbonitrile Openeye Name: 4-[3-(4-tert-butylphenoxy)propyl-(cyclopropylmethyl)amino]-2-(trifluoromethyl)benzonitrile CAS Name: 4-[3-(4-tert-butylphenoxy)propyl-(cyclopropylmethyl)amino]-2-(trifluoromethyl)benzonitrile IUPAC Name: 4-[3-(4-tert-butylphenoxy)propyl-(cyclopropylmethyl)amino]-2-(trifluoromethyl)benzonitrile Traditional Name: 4-[3-(4-tert-butylphenoxy)propyl-(cyclopropylmethyl)amino]-2-(trifluoromethyl)benzonitrile Formula: C25H29F3N2O MolecularWeight: 430.50577

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)OCCCN(CC2CC2)C3=CC(=C(C=C3)C#N)C(F)(F)F

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)OCCCN(CC2CC2)C3=CC(=C(C=C3)C#N)C(F)(F)F

InChI

InChI=1S/C25H29F3N2O/c1-24(2,3)20-8-11-22(12-9-20)31-14-4-13-30(17-18-5-6-18)21-10-7-19(16-29)23(15-21)25(26,27)28/h7-12,15,18H,4-6,13-14,17H2,1-3H3