butyl 5-(2,2-dimethylbutyl)-2-[3-(pyridin-2-ylamino)propoxy]benzoate

Systemtic Name: butyl 5-(2,2-dimethylbutyl)-2-[3-(pyridin-2-ylamino)propoxy]benzoate Openeye Name: butyl 5-(2,2-dimethylbutyl)-2-[3-(2-pyridylamino)propoxy]benzoate CAS Name: 5-(2,2-dimethylbutyl)-2-[3-(2-pyridinylamino)propoxy]benzoic acid butyl ester IUPAC Name: butyl 5-(2,2-dimethylbutyl)-2-[3-(pyridin-2-ylamino)propoxy]benzoate Traditional Name: 5-(2,2-dimethylbutyl)-2-[3-(2-pyridylamino)propoxy]benzoic acid butyl ester Formula: C25H36N2O3 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=C(C=CC(=C1)CC(C)(C)CC)OCCCNC2=CC=CC=N2

Isomeric SMILES

CCCCOC(=O)C1=C(C=CC(=C1)CC(C)(C)CC)OCCCNC2=CC=CC=N2

InChI

InChI=1S/C25H36N2O3/c1-5-7-16-30-24(28)21-18-20(19-25(3,4)6-2)12-13-22(21)29-17-10-15-27-23-11-8-9-14-26-23/h8-9,11-14,18H,5-7,10,15-17,19H2,1-4H3,(H,26,27)