6-bromanyl-2-(4-methoxyphenyl)-N-[1-(phenylmethyl)piperidin-4-yl]quinoline-4-carboxamide

Systemtic Name: 6-bromanyl-2-(4-methoxyphenyl)-N-[1-(phenylmethyl)piperidin-4-yl]quinoline-4-carboxamide Openeye Name: N-(1-benzyl-4-piperidyl)-6-bromo-2-(4-methoxyphenyl)quinoline-4-carboxamide CAS Name: 6-bromo-2-(4-methoxyphenyl)-N-[1-(phenylmethyl)-4-piperidinyl]-4-quinolinecarboxamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-6-bromo-2-(4-methoxyphenyl)quinoline-4-carboxamide Traditional Name: N-(1-benzyl-4-piperidyl)-6-bromo-2-(4-methoxyphenyl)cinchoninamide Formula: C29H28BrN3O2 MolecularWeight: 530.45552

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC=C(C=C1)C2=NC3=C(C=C(C=C3)Br)C(=C2)C(=O)NC4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H28BrN3O2/c1-35-24-10-7-21(8-11-24)28-18-26(25-17-22(30)9-12-27(25)32-28)29(34)31-23-13-15-33(16-14-23)19-20-5-3-2-4-6-20/h2-12,17-18,23H,13-16,19H2,1H3,(H,31,34)