tert-butyl 3-[2-methoxy-3-(phenylmethoxymethyl)pyridin-4-yl]-3-oxidanyl-pentanoate

Systemtic Name: tert-butyl 3-[2-methoxy-3-(phenylmethoxymethyl)pyridin-4-yl]-3-oxidanyl-pentanoate Openeye Name: tert-butyl 3-[3-(benzyloxymethyl)-2-methoxy-4-pyridyl]-3-hydroxy-pentanoate CAS Name: 3-hydroxy-3-[2-methoxy-3-(phenylmethoxymethyl)-4-pyridinyl]pentanoic acid tert-butyl ester IUPAC Name: tert-butyl 3-hydroxy-3-[2-methoxy-3-(phenylmethoxymethyl)pyridin-4-yl]pentanoate Traditional Name: 3-[3-(benzoxymethyl)-2-methoxy-4-pyridyl]-3-hydroxy-valeric acid tert-butyl ester Formula: C23H31NO5 MolecularWeight: 401.49594

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC(=O)OC(C)(C)C)(C1=C(C(=NC=C1)OC)COCC2=CC=CC=C2)O

Isomeric SMILES

CCC(CC(=O)OC(C)(C)C)(C1=C(C(=NC=C1)OC)COCC2=CC=CC=C2)O

InChI

InChI=1S/C23H31NO5/c1-6-23(26,14-20(25)29-22(2,3)4)19-12-13-24-21(27-5)18(19)16-28-15-17-10-8-7-9-11-17/h7-13,26H,6,14-16H2,1-5H3