ethyl 4-[2-(3,4-dimethylphenoxy)ethanoyl-(pyridin-3-ylmethyl)amino]benzoate

Systemtic Name: ethyl 4-[2-(3,4-dimethylphenoxy)ethanoyl-(pyridin-3-ylmethyl)amino]benzoate Openeye Name: ethyl 4-[[2-(3,4-dimethylphenoxy)acetyl]-(3-pyridylmethyl)amino]benzoate CAS Name: 4-[[2-(3,4-dimethylphenoxy)-1-oxoethyl]-(3-pyridinylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3,4-dimethylphenoxy)acetyl]-(pyridin-3-ylmethyl)amino]benzoate Traditional Name: 4-[[2-(3,4-dimethylphenoxy)acetyl]-(3-pyridylmethyl)amino]benzoic acid ethyl ester Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)N(CC2=CN=CC=C2)C(=O)COC3=CC(=C(C=C3)C)C

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(CC2=CN=CC=C2)C(=O)COC3=CC(=C(C=C3)C)C

InChI

InChI=1S/C25H26N2O4/c1-4-30-25(29)21-8-10-22(11-9-21)27(16-20-6-5-13-26-15-20)24(28)17-31-23-12-7-18(2)19(3)14-23/h5-15H,4,16-17H2,1-3H3