8-[2-[(E)-(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-8-oxidanylidene-octanoic acid

Systemtic Name: 8-[2-[(E)-(3-bromanyl-5-nitro-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-8-oxidanylidene-octanoic acid Openeye Name: 8-[2-[(E)-(3-bromo-5-nitro-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-8-oxo-octanoic acid CAS Name: 8-[[(E)-(3-bromo-5-nitro-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]hydrazo]-8-oxooctanoic acid IUPAC Name: 8-[2-[(E)-(3-bromo-5-nitro-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]hydrazinyl]-8-oxooctanoic acid Traditional Name: 8-[N'-[(E)-(3-bromo-6-keto-5-nitro-cyclohexa-2,4-dien-1-ylidene)methyl]hydrazino]-8-keto-caprylic acid Formula: C15H18BrN3O6 MolecularWeight: 416.22392

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Descriptors Computed from Structure

Canonical SMILES:

C1=C(C=C(C(=O)C1=CNNC(=O)CCCCCCC(=O)O)[N+](=O)[O-])Br

Isomeric SMILES

C\1=C(C=C(C(=O)/C1=C/NNC(=O)CCCCCCC(=O)O)[N+](=O)[O-])Br

InChI

InChI=1S/C15H18BrN3O6/c16-11-7-10(15(23)12(8-11)19(24)25)9-17-18-13(20)5-3-1-2-4-6-14(21)22/h7-9,17H,1-6H2,(H,18,20)(H,21,22)/b10-9+