ethyl 4-[[3-(2-methylpropoxy)phenyl]carbonyl-(pyridin-3-ylmethyl)amino]benzoate

Systemtic Name: ethyl 4-[[3-(2-methylpropoxy)phenyl]carbonyl-(pyridin-3-ylmethyl)amino]benzoate Openeye Name: ethyl 4-[(3-isobutoxybenzoyl)-(3-pyridylmethyl)amino]benzoate CAS Name: 4-[[[3-(2-methylpropoxy)phenyl]-oxomethyl]-(3-pyridinylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[[3-(2-methylpropoxy)benzoyl]-(pyridin-3-ylmethyl)amino]benzoate Traditional Name: 4-[(3-isobutoxybenzoyl)-(3-pyridylmethyl)amino]benzoic acid ethyl ester Formula: C26H28N2O4 MolecularWeight: 432.51152

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H28N2O4/c1-4-31-26(30)21-10-12-23(13-11-21)28(17-20-7-6-14-27-16-20)25(29)22-8-5-9-24(15-22)32-18-19(2)3/h5-16,19H,4,17-18H2,1-3H3