methyl 4-[[[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]carbonyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[[6-(3-bromophenyl)-2-methyl-pyridin-3-yl]carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[[6-(3-bromophenyl)-2-methyl-pyridine-3-carbonyl]-methyl-amino]methyl]benzoate CAS Name: 4-[[[[6-(3-bromophenyl)-2-methyl-3-pyridinyl]-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[[6-(3-bromophenyl)-2-methylpyridine-3-carbonyl]-methylamino]methyl]benzoate Traditional Name: 4-[[[6-(3-bromophenyl)-2-methyl-nicotinoyl]-methyl-amino]methyl]benzoic acid methyl ester Formula: C23H21BrN2O3 MolecularWeight: 453.32844

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)N(C)CC3=CC=C(C=C3)C(=O)OC

Isomeric SMILES

CC1=C(C=CC(=N1)C2=CC(=CC=C2)Br)C(=O)N(C)CC3=CC=C(C=C3)C(=O)OC

InChI

InChI=1S/C23H21BrN2O3/c1-15-20(11-12-21(25-15)18-5-4-6-19(24)13-18)22(27)26(2)14-16-7-9-17(10-8-16)23(28)29-3/h4-13H,14H2,1-3H3