3-[3-[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]propyl]piperidine-1-carboxamide

Systemtic Name: 3-[3-[4-[(2-bromanyl-5-methoxy-phenyl)methyl]piperidin-1-yl]propyl]piperidine-1-carboxamide Openeye Name: 3-[3-[4-[(2-bromo-5-methoxy-phenyl)methyl]-1-piperidyl]propyl]piperidine-1-carboxamide CAS Name: 3-[3-[4-[(2-bromo-5-methoxyphenyl)methyl]-1-piperidinyl]propyl]-1-piperidinecarboxamide IUPAC Name: 3-[3-[4-[(2-bromo-5-methoxyphenyl)methyl]piperidin-1-yl]propyl]piperidine-1-carboxamide Traditional Name: 3-[3-[4-(2-bromo-5-methoxy-benzyl)piperidino]propyl]piperidine-1-carboxamide Formula: C22H34BrN3O2 MolecularWeight: 452.42826

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)Br)CC2CCN(CC2)CCCC3CCCN(C3)C(=O)N

Isomeric SMILES

COC1=CC(=C(C=C1)Br)CC2CCN(CC2)CCCC3CCCN(C3)C(=O)N

InChI

InChI=1S/C22H34BrN3O2/c1-28-20-6-7-21(23)19(15-20)14-17-8-12-25(13-9-17)10-2-4-18-5-3-11-26(16-18)22(24)27/h6-7,15,17-18H,2-5,8-14,16H2,1H3,(H2,24,27)