[4,5-bis(chloranyl)-1H-pyrrol-2-yl]-(1,4-diazepan-4-ium-1-yl)methanone

Systemtic Name: [4,5-bis(chloranyl)-1H-pyrrol-2-yl]-(1,4-diazepan-4-ium-1-yl)methanone Openeye Name: 1,4-diazepan-4-ium-1-yl-(4,5-dichloro-1H-pyrrol-2-yl)methanone CAS Name: 1,4-diazepan-4-ium-1-yl-(4,5-dichloro-1H-pyrrol-2-yl)methanone IUPAC Name: 1,4-diazepan-4-ium-1-yl-(4,5-dichloro-1H-pyrrol-2-yl)methanone Traditional Name: 1,4-diazepan-4-ium-1-yl-(4,5-dichloro-1H-pyrrol-2-yl)methanone Formula: C10H14Cl2N3O+ MolecularWeight: 263.14366

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH2+]CCN(C1)C(=O)C2=CC(=C(N2)Cl)Cl

Isomeric SMILES

C1C[NH2+]CCN(C1)C(=O)C2=CC(=C(N2)Cl)Cl

InChI

InChI=1S/C10H13Cl2N3O/c11-7-6-8(14-9(7)12)10(16)15-4-1-2-13-3-5-15/h6,13-14H,1-5H2/p+1