ethyl 4-[2-(3,5-dimethylphenoxy)ethanoyl-(pyridin-4-ylmethyl)amino]benzoate

Systemtic Name: ethyl 4-[2-(3,5-dimethylphenoxy)ethanoyl-(pyridin-4-ylmethyl)amino]benzoate Openeye Name: ethyl 4-[[2-(3,5-dimethylphenoxy)acetyl]-(4-pyridylmethyl)amino]benzoate CAS Name: 4-[[2-(3,5-dimethylphenoxy)-1-oxoethyl]-(pyridin-4-ylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[2-(3,5-dimethylphenoxy)acetyl]-(pyridin-4-ylmethyl)amino]benzoate Traditional Name: 4-[[2-(3,5-dimethylphenoxy)acetyl]-(4-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=CC=NC=C2)C(=O)COC3=CC(=CC(=C3)C)C

Isomeric SMILES

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

InChI

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