[4-[4-[(4-bromophenyl)-oxidanyl-methyl]piperidin-1-yl]-4-methyl-piperidin-1-yl]-quinolin-4-yl-methanone

Systemtic Name: [4-[4-[(4-bromophenyl)-oxidanyl-methyl]piperidin-1-yl]-4-methyl-piperidin-1-yl]-quinolin-4-yl-methanone Openeye Name: [4-[4-[(4-bromophenyl)-hydroxy-methyl]-1-piperidyl]-4-methyl-1-piperidyl]-(4-quinolyl)methanone CAS Name: [4-[4-[(4-bromophenyl)-hydroxymethyl]-1-piperidinyl]-4-methyl-1-piperidinyl]-(4-quinolinyl)methanone IUPAC Name: [4-[4-[(4-bromophenyl)-hydroxymethyl]piperidin-1-yl]-4-methylpiperidin-1-yl]-quinolin-4-ylmethanone Traditional Name: [4-[4-[(4-bromophenyl)-hydroxy-methyl]piperidino]-4-methyl-piperidino]-(4-quinolyl)methanone Formula: C28H32BrN3O2 MolecularWeight: 522.47658

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Descriptors Computed from Structure

Canonical SMILES:

CC1(CCN(CC1)C(=O)C2=CC=NC3=CC=CC=C23)N4CCC(CC4)C(C5=CC=C(C=C5)Br)O

Isomeric SMILES

CC1(CCN(CC1)C(=O)C2=CC=NC3=CC=CC=C23)N4CCC(CC4)C(C5=CC=C(C=C5)Br)O

InChI

InChI=1S/C28H32BrN3O2/c1-28(32-16-11-21(12-17-32)26(33)20-6-8-22(29)9-7-20)13-18-31(19-14-28)27(34)24-10-15-30-25-5-3-2-4-23(24)25/h2-10,15,21,26,33H,11-14,16-19H2,1H3