ethyl 3-[[4-methoxy-3-(oxolan-2-yloxy)phenyl]-(pyridin-3-ylmethyl)amino]benzoate

Systemtic Name: ethyl 3-[[4-methoxy-3-(oxolan-2-yloxy)phenyl]-(pyridin-3-ylmethyl)amino]benzoate Openeye Name: ethyl 3-[4-methoxy-N-(3-pyridylmethyl)-3-tetrahydrofuran-2-yloxy-anilino]benzoate CAS Name: 3-[4-methoxy-3-(2-oxolanyloxy)-N-(3-pyridinylmethyl)anilino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[4-methoxy-3-(oxolan-2-yloxy)-N-(pyridin-3-ylmethyl)anilino]benzoate Traditional Name: 3-[4-methoxy-N-(3-pyridylmethyl)-3-(tetrahydrofuryloxy)anilino]benzoic acid ethyl ester Formula: C26H28N2O5 MolecularWeight: 448.51092

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC=C1)N(CC2=CN=CC=C2)C3=CC(=C(C=C3)OC)OC4CCCO4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N(CC2=CN=CC=C2)C3=CC(=C(C=C3)OC)OC4CCCO4

InChI

InChI=1S/C26H28N2O5/c1-3-31-26(29)20-8-4-9-21(15-20)28(18-19-7-5-13-27-17-19)22-11-12-23(30-2)24(16-22)33-25-10-6-14-32-25/h4-5,7-9,11-13,15-17,25H,3,6,10,14,18H2,1-2H3