ethyl 3-methyl-4-[3-[3-(pyridin-2-ylamino)propoxy]phenyl]butanoate

Systemtic Name: ethyl 3-methyl-4-[3-[3-(pyridin-2-ylamino)propoxy]phenyl]butanoate Openeye Name: ethyl 3-methyl-4-[3-[3-(2-pyridylamino)propoxy]phenyl]butanoate CAS Name: 3-methyl-4-[3-[3-(2-pyridinylamino)propoxy]phenyl]butanoic acid ethyl ester IUPAC Name: ethyl 3-methyl-4-[3-[3-(pyridin-2-ylamino)propoxy]phenyl]butanoate Traditional Name: 3-methyl-4-[3-[3-(2-pyridylamino)propoxy]phenyl]butyric acid ethyl ester Formula: C21H28N2O3 MolecularWeight: 356.45862

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(C)CC1=CC(=CC=C1)OCCCNC2=CC=CC=N2

Isomeric SMILES

CCOC(=O)CC(C)CC1=CC(=CC=C1)OCCCNC2=CC=CC=N2

InChI

InChI=1S/C21H28N2O3/c1-3-25-21(24)15-17(2)14-18-8-6-9-19(16-18)26-13-7-12-23-20-10-4-5-11-22-20/h4-6,8-11,16-17H,3,7,12-15H2,1-2H3,(H,22,23)