4-(2-bromoethyl)-2-[(Z)-[4-(2-bromoethyl)-3,5-dimethyl-pyrrol-1-ium-2-ylidene]methyl]-3,5-dimethyl-1H-pyrrole bromide

Systemtic Name: 4-(2-bromoethyl)-2-[(Z)-[4-(2-bromoethyl)-3,5-dimethyl-pyrrol-1-ium-2-ylidene]methyl]-3,5-dimethyl-1H-pyrrole bromide Openeye Name: 4-(2-bromoethyl)-2-[(Z)-[4-(2-bromoethyl)-3,5-dimethyl-pyrrol-1-ium-2-ylidene]methyl]-3,5-dimethyl-1H-pyrrole bromide CAS Name: 4-(2-bromoethyl)-2-[(Z)-[4-(2-bromoethyl)-3,5-dimethyl-2-pyrrol-1-iumylidene]methyl]-3,5-dimethyl-1H-pyrrole bromide IUPAC Name: 4-(2-bromoethyl)-2-[(Z)-[4-(2-bromoethyl)-3,5-dimethylpyrrol-1-ium-2-ylidene]methyl]-3,5-dimethyl-1H-pyrrole bromide Traditional Name: 4-(2-bromoethyl)-2-[(Z)-[4-(2-bromoethyl)-3,5-dimethyl-pyrrol-1-ium-2-ylidene]methyl]-3,5-dimethyl-1H-pyrrole bromide Formula: C17H23Br3N2 MolecularWeight: 495.08992

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=[NH+]C1=CC2=C(C(=C(N2)C)CCBr)C)C)CCBr.[Br-]

Isomeric SMILES

CC\1=C(C(=[NH+]/C1=C\C2=C(C(=C(N2)C)CCBr)C)C)CCBr.[Br-]

InChI

InChI=1S/C17H22Br2N2.BrH/c1-10-14(5-7-18)12(3)20-16(10)9-17-11(2)15(6-8-19)13(4)21-17;/h9,20H,5-8H2,1-4H3;1H/b17-9-;