N-[2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-5-bromanyl-furan-2-carboxamide

Systemtic Name: N-[2-[4-[2-(azepan-1-yl)-2-oxidanylidene-ethyl]piperazin-4-ium-1-yl]-2-oxidanylidene-ethyl]-5-bromanyl-furan-2-carboxamide Openeye Name: N-[2-[4-[2-(azepan-1-yl)-2-oxo-ethyl]piperazin-4-ium-1-yl]-2-oxo-ethyl]-5-bromo-furan-2-carboxamide CAS Name: N-[2-[4-[2-(1-azepanyl)-2-oxoethyl]-1-piperazin-4-iumyl]-2-oxoethyl]-5-bromo-2-furancarboxamide IUPAC Name: N-[2-[4-[2-(azepan-1-yl)-2-oxoethyl]piperazin-4-ium-1-yl]-2-oxoethyl]-5-bromofuran-2-carboxamide Traditional Name: N-[2-[4-[2-(azepan-1-yl)-2-keto-ethyl]piperazin-4-ium-1-yl]-2-keto-ethyl]-5-bromo-2-furamide Formula: C19H28BrN4O4+ MolecularWeight: 456.35402

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)CNC(=O)C3=CC=C(O3)Br

Isomeric SMILES

C1CCCN(CC1)C(=O)C[NH+]2CCN(CC2)C(=O)CNC(=O)C3=CC=C(O3)Br

InChI

InChI=1S/C19H27BrN4O4/c20-16-6-5-15(28-16)19(27)21-13-17(25)24-11-9-22(10-12-24)14-18(26)23-7-3-1-2-4-8-23/h5-6H,1-4,7-14H2,(H,21,27)/p+1