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

Systemtic Name: ethyl 3-[(3-cyclopentyloxy-4-methoxy-phenyl)-(pyridin-3-ylmethyl)amino]benzoate Openeye Name: ethyl 3-[3-(cyclopentoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]benzoate CAS Name: 3-[3-cyclopentyloxy-4-methoxy-N-(3-pyridinylmethyl)anilino]benzoic acid ethyl ester IUPAC Name: ethyl 3-[3-cyclopentyloxy-4-methoxy-N-(pyridin-3-ylmethyl)anilino]benzoate Traditional Name: 3-[3-(cyclopentoxy)-4-methoxy-N-(3-pyridylmethyl)anilino]benzoic acid ethyl ester Formula: C27H30N2O4 MolecularWeight: 446.5381

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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)OC4CCCC4

Isomeric SMILES

CCOC(=O)C1=CC(=CC=C1)N(CC2=CN=CC=C2)C3=CC(=C(C=C3)OC)OC4CCCC4

InChI

InChI=1S/C27H30N2O4/c1-3-32-27(30)21-9-6-10-22(16-21)29(19-20-8-7-15-28-18-20)23-13-14-25(31-2)26(17-23)33-24-11-4-5-12-24/h6-10,13-18,24H,3-5,11-12,19H2,1-2H3