ethyl 4-[(5-bromanylnaphthalen-1-yl)carbonyl-(pyridin-3-ylmethyl)amino]benzoate

Systemtic Name: ethyl 4-[(5-bromanylnaphthalen-1-yl)carbonyl-(pyridin-3-ylmethyl)amino]benzoate Openeye Name: ethyl 4-[(5-bromonaphthalene-1-carbonyl)-(3-pyridylmethyl)amino]benzoate CAS Name: 4-[[(5-bromo-1-naphthalenyl)-oxomethyl]-(3-pyridinylmethyl)amino]benzoic acid ethyl ester IUPAC Name: ethyl 4-[(5-bromonaphthalene-1-carbonyl)-(pyridin-3-ylmethyl)amino]benzoate Traditional Name: 4-[(5-bromo-1-naphthoyl)-(3-pyridylmethyl)amino]benzoic acid ethyl ester Formula: C26H21BrN2O3 MolecularWeight: 489.36054

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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=CC4=C3C=CC=C4Br

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)N(CC2=CN=CC=C2)C(=O)C3=CC=CC4=C3C=CC=C4Br

InChI

InChI=1S/C26H21BrN2O3/c1-2-32-26(31)19-11-13-20(14-12-19)29(17-18-6-5-15-28-16-18)25(30)23-9-3-8-22-21(23)7-4-10-24(22)27/h3-16H,2,17H2,1H3