2-[4-[(5-bromanyl-2-methoxy-phenyl)methyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone

Systemtic Name: 2-[4-[(5-bromanyl-2-methoxy-phenyl)methyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone Openeye Name: 2-[4-[(5-bromo-2-methoxy-phenyl)methyl]piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone CAS Name: 2-[4-[(5-bromo-2-methoxyphenyl)methyl]-1-piperazinyl]-1-(1-pyrrolidinyl)ethanone IUPAC Name: 2-[4-[(5-bromo-2-methoxyphenyl)methyl]piperazin-1-yl]-1-pyrrolidin-1-ylethanone Traditional Name: 2-[4-(5-bromo-2-methoxy-benzyl)piperazino]-1-pyrrolidino-ethanone Formula: C18H26BrN3O2 MolecularWeight: 396.32194

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)CN2CCN(CC2)CC(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)CN2CCN(CC2)CC(=O)N3CCCC3

InChI

InChI=1S/C18H26BrN3O2/c1-24-17-5-4-16(19)12-15(17)13-20-8-10-21(11-9-20)14-18(23)22-6-2-3-7-22/h4-5,12H,2-3,6-11,13-14H2,1H3