ethyl 4-[4-[2-[6-(methylamino)pyridin-2-yl]ethoxy]phenyl]-3-pyridin-3-yl-butanoate

Systemtic Name: ethyl 4-[4-[2-[6-(methylamino)pyridin-2-yl]ethoxy]phenyl]-3-pyridin-3-yl-butanoate Openeye Name: ethyl 4-[4-[2-[6-(methylamino)-2-pyridyl]ethoxy]phenyl]-3-(3-pyridyl)butanoate CAS Name: 4-[4-[2-[6-(methylamino)-2-pyridinyl]ethoxy]phenyl]-3-(3-pyridinyl)butanoic acid ethyl ester IUPAC Name: ethyl 4-[4-[2-[6-(methylamino)pyridin-2-yl]ethoxy]phenyl]-3-pyridin-3-ylbutanoate Traditional Name: 4-[4-[2-[6-(methylamino)-2-pyridyl]ethoxy]phenyl]-3-(3-pyridyl)butyric acid ethyl ester Formula: C25H29N3O3 MolecularWeight: 419.51606

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(CC1=CC=C(C=C1)OCCC2=NC(=CC=C2)NC)C3=CN=CC=C3

Isomeric SMILES

CCOC(=O)CC(CC1=CC=C(C=C1)OCCC2=NC(=CC=C2)NC)C3=CN=CC=C3

InChI

InChI=1S/C25H29N3O3/c1-3-30-25(29)17-21(20-6-5-14-27-18-20)16-19-9-11-23(12-10-19)31-15-13-22-7-4-8-24(26-2)28-22/h4-12,14,18,21H,3,13,15-17H2,1-2H3,(H,26,28)