[(3R)-1-[(5-bromanyl-2-methoxy-phenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-yl-methanone

Systemtic Name: [(3R)-1-[(5-bromanyl-2-methoxy-phenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-yl-methanone Openeye Name: [(3R)-1-[(5-bromo-2-methoxy-phenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-yl-methanone CAS Name: [(3R)-1-[(5-bromo-2-methoxyphenyl)methyl]-3-piperidin-1-iumyl]-(1-pyrrolidinyl)methanone IUPAC Name: [(3R)-1-[(5-bromo-2-methoxyphenyl)methyl]piperidin-1-ium-3-yl]-pyrrolidin-1-ylmethanone Traditional Name: [(3R)-1-(5-bromo-2-methoxy-benzyl)piperidin-1-ium-3-yl]-pyrrolidino-methanone Formula: C18H26BrN2O2+ MolecularWeight: 382.31524

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)Br)C[NH+]2CCCC(C2)C(=O)N3CCCC3

Isomeric SMILES

COC1=C(C=C(C=C1)Br)C[NH+]2CCC[C@H](C2)C(=O)N3CCCC3

InChI

InChI=1S/C18H25BrN2O2/c1-23-17-7-6-16(19)11-15(17)13-20-8-4-5-14(12-20)18(22)21-9-2-3-10-21/h6-7,11,14H,2-5,8-10,12-13H2,1H3/p+1/t14-/m1/s1