N-[2-[(1S)-6-bromanyl-3,4-dihydro-1H-isochromen-1-yl]ethyl]-N-methyl-1-phenyl-piperidin-4-amine dihydrochloride

Systemtic Name: N-[2-[(1S)-6-bromanyl-3,4-dihydro-1H-isochromen-1-yl]ethyl]-N-methyl-1-phenyl-piperidin-4-amine dihydrochloride Openeye Name: N-[2-[(1S)-6-bromoisochroman-1-yl]ethyl]-N-methyl-1-phenyl-piperidin-4-amine dihydrochloride CAS Name: N-[2-[(1S)-6-bromo-3,4-dihydro-1H-2-benzopyran-1-yl]ethyl]-N-methyl-1-phenyl-4-piperidinamine dihydrochloride IUPAC Name: N-[2-[(1S)-6-bromo-3,4-dihydro-1H-isochromen-1-yl]ethyl]-N-methyl-1-phenylpiperidin-4-amine dihydrochloride Traditional Name: 2-[(1S)-6-bromoisochroman-1-yl]ethyl-methyl-(1-phenyl-4-piperidyl)amine dihydrochloride Formula: C23H31BrCl2N2O MolecularWeight: 502.31504

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Descriptors Computed from Structure

Canonical SMILES:

CN(CCC1C2=C(CCO1)C=C(C=C2)Br)C3CCN(CC3)C4=CC=CC=C4.Cl.Cl

Isomeric SMILES

CN(CC[C@H]1C2=C(CCO1)C=C(C=C2)Br)C3CCN(CC3)C4=CC=CC=C4.Cl.Cl

InChI

InChI=1S/C23H29BrN2O.2ClH/c1-25(20-9-14-26(15-10-20)21-5-3-2-4-6-21)13-11-23-22-8-7-19(24)17-18(22)12-16-27-23;;/h2-8,17,20,23H,9-16H2,1H3;2*1H/t23-;;/m0../s1