ethyl 4-[[3,5-bis(chloranyl)-2-methoxy-phenyl]carbonyl-(pyridin-3-ylmethyl)amino]benzoate

Systemtic Name: ethyl 4-[[3,5-bis(chloranyl)-2-methoxy-phenyl]carbonyl-(pyridin-3-ylmethyl)amino]benzoate Openeye Name: ethyl 4-[(3,5-dichloro-2-methoxy-benzoyl)-(3-pyridylmethyl)amino]benzoate CAS Name: 4-[[(3,5-dichloro-2-methoxyphenyl)-oxomethyl]-(3-pyridinylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(3,5-dichloro-2-methoxybenzoyl)-(pyridin-3-ylmethyl)amino]benzoate Traditional Name: 4-[(3,5-dichloro-2-methoxy-benzoyl)-(3-pyridylmethyl)amino]benzoic acid ethyl ester Formula: C23H20Cl2N2O4 MolecularWeight: 459.3219

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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(=C3OC)Cl)Cl

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(CC2=CN=CC=C2)C(=O)C3=CC(=CC(=C3OC)Cl)Cl

InChI

InChI=1S/C23H20Cl2N2O4/c1-3-31-23(29)16-6-8-18(9-7-16)27(14-15-5-4-10-26-13-15)22(28)19-11-17(24)12-20(25)21(19)30-2/h4-13H,3,14H2,1-2H3