1-[2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide

Systemtic Name: 1-[2-[[2,6-bis(bromanyl)-4-nitro-phenyl]amino]-2-oxidanylidene-ethyl]piperidin-1-ium-4-carboxamide Openeye Name: 1-[2-(2,6-dibromo-4-nitro-anilino)-2-oxo-ethyl]piperidin-1-ium-4-carboxamide CAS Name: 1-[2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl]-4-piperidin-1-iumcarboxamide IUPAC Name: 1-[2-(2,6-dibromo-4-nitroanilino)-2-oxoethyl]piperidin-1-ium-4-carboxamide Traditional Name: 1-[2-(2,6-dibromo-4-nitro-anilino)-2-keto-ethyl]piperidin-1-ium-4-carboxamide Formula: C14H17Br2N4O4+ MolecularWeight: 465.11718

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Descriptors Computed from Structure

Canonical SMILES:

C1C[NH+](CCC1C(=O)N)CC(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br

Isomeric SMILES

C1C[NH+](CCC1C(=O)N)CC(=O)NC2=C(C=C(C=C2Br)[N+](=O)[O-])Br

InChI

InChI=1S/C14H16Br2N4O4/c15-10-5-9(20(23)24)6-11(16)13(10)18-12(21)7-19-3-1-8(2-4-19)14(17)22/h5-6,8H,1-4,7H2,(H2,17,22)(H,18,21)/p+1