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

Systemtic Name: 8-[2-[(E)-(2-bromanyl-5-methoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-8-oxidanylidene-octanoic acid Openeye Name: 8-[2-[(E)-(2-bromo-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-8-oxo-octanoic acid CAS Name: 8-[[(E)-(2-bromo-5-methoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methyl]hydrazo]-8-oxooctanoic acid IUPAC Name: 8-[2-[(E)-(2-bromo-5-methoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-8-oxooctanoic acid Traditional Name: 8-[N'-[(E)-(2-bromo-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-8-keto-caprylic acid Formula: C16H21BrN2O5 MolecularWeight: 401.25234

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)CCCCCCC(=O)O)C(=CC1=O)Br

Isomeric SMILES

COC1=C/C(=C\NNC(=O)CCCCCCC(=O)O)/C(=CC1=O)Br

InChI

InChI=1S/C16H21BrN2O5/c1-24-14-8-11(12(17)9-13(14)20)10-18-19-15(21)6-4-2-3-5-7-16(22)23/h8-10,18H,2-7H2,1H3,(H,19,21)(H,22,23)/b11-10+