3-[2-[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]ethyl]-5-chloranyl-benzamide

Systemtic Name: 3-[2-[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]ethyl]-5-chloranyl-benzamide Openeye Name: 3-[2-[4-[(2-bromo-5-methoxy-phenyl)methyl]-1-piperidyl]ethyl]-5-chloro-benzamide CAS Name: 3-[2-[4-[(2-bromo-5-methoxyphenyl)methyl]-1-piperidinyl]ethyl]-5-chlorobenzamide IUPAC Name: 3-[2-[4-[(2-bromo-5-methoxyphenyl)methyl]piperidin-1-yl]ethyl]-5-chlorobenzamide Traditional Name: 3-[2-[4-(2-bromo-5-methoxy-benzyl)piperidino]ethyl]-5-chloro-benzamide Formula: C22H26BrClN2O2 MolecularWeight: 465.81104

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)CC2CCN(CC2)CCC3=CC(=CC(=C3)C(=O)N)Cl

Isomeric SMILES

COC1=CC(=C(C=C1)Br)CC2CCN(CC2)CCC3=CC(=CC(=C3)C(=O)N)Cl

InChI

InChI=1S/C22H26BrClN2O2/c1-28-20-2-3-21(23)17(14-20)10-15-4-7-26(8-5-15)9-6-16-11-18(22(25)27)13-19(24)12-16/h2-3,11-15H,4-10H2,1H3,(H2,25,27)