ethyl 3-[[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-(pyridin-3-ylmethyl)amino]benzoate

Systemtic Name: ethyl 3-[[3-(cyclopropylmethoxy)-4-methoxy-phenyl]-(pyridin-3-ylmethyl)amino]benzoate Openeye Name: ethyl 3-[3-(cyclopropylmethoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]benzoate CAS Name: 3-[3-(cyclopropylmethoxy)-4-methoxy-N-(3-pyridinylmethyl)anilino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-(cyclopropylmethoxy)-4-methoxy-N-(pyridin-3-ylmethyl)anilino]benzoate Traditional Name: 3-[3-(cyclopropylmethoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]benzoic acid ethyl ester Formula: C26H28N2O4 MolecularWeight: 432.51152

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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)OCC4CC4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N(CC2=CN=CC=C2)C3=CC(=C(C=C3)OC)OCC4CC4

InChI

InChI=1S/C26H28N2O4/c1-3-31-26(29)21-7-4-8-22(14-21)28(17-20-6-5-13-27-16-20)23-11-12-24(30-2)25(15-23)32-18-19-9-10-19/h4-8,11-16,19H,3,9-10,17-18H2,1-2H3