N-[6-[2-[(3-bromanyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-6-oxidanylidene-hexyl]-2-chloranyl-benzamide

Systemtic Name: N-[6-[2-[(3-bromanyl-5-ethoxy-4-oxidanylidene-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-6-oxidanylidene-hexyl]-2-chloranyl-benzamide Openeye Name: N-[6-[2-[(3-bromo-5-ethoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-6-oxo-hexyl]-2-chloro-benzamide CAS Name: N-[6-[(3-bromo-5-ethoxy-4-oxo-1-cyclohexa-2,5-dienylidene)methylhydrazo]-6-oxohexyl]-2-chlorobenzamide IUPAC Name: N-[6-[2-[(3-bromo-5-ethoxy-4-oxocyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-6-oxohexyl]-2-chlorobenzamide Traditional Name: N-[6-[N'-[(3-bromo-5-ethoxy-4-keto-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-6-keto-hexyl]-2-chloro-benzamide Formula: C22H25BrClN3O4 MolecularWeight: 510.8086

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC(=CNNC(=O)CCCCCNC(=O)C2=CC=CC=C2Cl)C=C(C1=O)Br

Isomeric SMILES

CCOC1=CC(=CNNC(=O)CCCCCNC(=O)C2=CC=CC=C2Cl)C=C(C1=O)Br

InChI

InChI=1S/C22H25BrClN3O4/c1-2-31-19-13-15(12-17(23)21(19)29)14-26-27-20(28)10-4-3-7-11-25-22(30)16-8-5-6-9-18(16)24/h5-6,8-9,12-14,26H,2-4,7,10-11H2,1H3,(H,25,30)(H,27,28)