4-(2-iodanylpyrrol-1-yl)-1-(phenylmethyl)piperidin-1-ium

Systemtic Name: 4-(2-iodanylpyrrol-1-yl)-1-(phenylmethyl)piperidin-1-ium Openeye Name: 1-benzyl-4-(2-iodopyrrol-1-yl)piperidin-1-ium CAS Name: 4-(2-iodo-1-pyrrolyl)-1-(phenylmethyl)piperidin-1-ium IUPAC Name: 1-benzyl-4-(2-iodopyrrol-1-yl)piperidin-1-ium Traditional Name: 1-benzyl-4-(2-iodopyrrol-1-yl)piperidin-1-ium Formula: C16H20IN2+ MolecularWeight: 367.24787

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1N2C=CC=C2I)CC3=CC=CC=C3

Isomeric SMILES

C1C[NH+](CCC1N2C=CC=C2I)CC3=CC=CC=C3

InChI

InChI=1S/C16H19IN2/c17-16-7-4-10-19(16)15-8-11-18(12-9-15)13-14-5-2-1-3-6-14/h1-7,10,15H,8-9,11-13H2/p+1