N-[3-[(4-bromophenyl)carbonylamino]propyl]-4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-carboxamide

Systemtic Name: N-[3-[(4-bromophenyl)carbonylamino]propyl]-4-methyl-5-oxidanidyl-1,2,5-oxadiazol-5-ium-3-carboxamide Openeye Name: N-[3-[(4-bromobenzoyl)amino]propyl]-4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxamide CAS Name: N-[3-[[(4-bromophenyl)-oxomethyl]amino]propyl]-4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxamide IUPAC Name: N-[3-[(4-bromobenzoyl)amino]propyl]-4-methyl-5-oxido-1,2,5-oxadiazol-5-ium-3-carboxamide Traditional Name: N-[3-[(4-bromobenzoyl)amino]propyl]-4-methyl-5-oxido-furazan-5-ium-3-carboxamide Formula: C14H15BrN4O4 MolecularWeight: 383.1973

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Descriptors Computed from Structure

Canonical SMILES:

CC1=[N+](ON=C1C(=O)NCCCNC(=O)C2=CC=C(C=C2)Br)[O-]

Isomeric SMILES

CC1=[N+](ON=C1C(=O)NCCCNC(=O)C2=CC=C(C=C2)Br)[O-]

InChI

InChI=1S/C14H15BrN4O4/c1-9-12(18-23-19(9)22)14(21)17-8-2-7-16-13(20)10-3-5-11(15)6-4-10/h3-6H,2,7-8H2,1H3,(H,16,20)(H,17,21)