[2-butyl-2-piperazin-1-yl-3-(2-propan-2-yloxyphenyl)piperidin-1-yl]-phenyl-methanone dihydrobromide

Systemtic Name: [2-butyl-2-piperazin-1-yl-3-(2-propan-2-yloxyphenyl)piperidin-1-yl]-phenyl-methanone dihydrobromide Openeye Name: [2-butyl-3-(2-isopropoxyphenyl)-2-piperazin-1-yl-1-piperidyl]-phenyl-methanone dihydrobromide CAS Name: [2-butyl-2-(1-piperazinyl)-3-(2-propan-2-yloxyphenyl)-1-piperidinyl]-phenylmethanone dihydrobromide IUPAC Name: [2-butyl-2-piperazin-1-yl-3-(2-propan-2-yloxyphenyl)piperidin-1-yl]-phenylmethanone dihydrobromide Traditional Name: [2-butyl-3-(2-isopropoxyphenyl)-2-piperazino-piperidino]-phenyl-methanone dihydrobromide Formula: C29H43Br2N3O2 MolecularWeight: 625.47862

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1(C(CCCN1C(=O)C2=CC=CC=C2)C3=CC=CC=C3OC(C)C)N4CCNCC4.Br.Br

Isomeric SMILES

CCCCC1(C(CCCN1C(=O)C2=CC=CC=C2)C3=CC=CC=C3OC(C)C)N4CCNCC4.Br.Br

InChI

InChI=1S/C29H41N3O2.2BrH/c1-4-5-17-29(31-21-18-30-19-22-31)26(25-14-9-10-16-27(25)34-23(2)3)15-11-20-32(29)28(33)24-12-7-6-8-13-24;;/h6-10,12-14,16,23,26,30H,4-5,11,15,17-22H2,1-3H3;2*1H