(2S)-4-(5-bromanyl-6-methoxy-pyridin-2-yl)-1-[(3,4-dimethoxyphenyl)methyl]-2-methyl-piperazine

Systemtic Name: (2S)-4-(5-bromanyl-6-methoxy-pyridin-2-yl)-1-[(3,4-dimethoxyphenyl)methyl]-2-methyl-piperazine Openeye Name: (2S)-4-(5-bromo-6-methoxy-2-pyridyl)-1-[(3,4-dimethoxyphenyl)methyl]-2-methyl-piperazine CAS Name: (2S)-4-(5-bromo-6-methoxy-2-pyridinyl)-1-[(3,4-dimethoxyphenyl)methyl]-2-methylpiperazine IUPAC Name: (2S)-4-(5-bromo-6-methoxypyridin-2-yl)-1-[(3,4-dimethoxyphenyl)methyl]-2-methylpiperazine Traditional Name: (2S)-4-(5-bromo-6-methoxy-2-pyridyl)-2-methyl-1-veratryl-piperazine Formula: C20H26BrN3O3 MolecularWeight: 436.34274

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Descriptors Computed from Structure

Canonical SMILES:

CC1CN(CCN1CC2=CC(=C(C=C2)OC)OC)C3=NC(=C(C=C3)Br)OC

Isomeric SMILES

C[C@H]1CN(CCN1CC2=CC(=C(C=C2)OC)OC)C3=NC(=C(C=C3)Br)OC

InChI

InChI=1S/C20H26BrN3O3/c1-14-12-24(19-8-6-16(21)20(22-19)27-4)10-9-23(14)13-15-5-7-17(25-2)18(11-15)26-3/h5-8,11,14H,9-10,12-13H2,1-4H3/t14-/m0/s1