N-[4-[[(E)-(3-iodanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]butyl]-2-oxidanyl-benzamide

Systemtic Name: N-[4-[[(E)-(3-iodanyl-6-oxidanylidene-cyclohexa-2,4-dien-1-ylidene)methyl]amino]butyl]-2-oxidanyl-benzamide Openeye Name: 2-hydroxy-N-[4-[[(E)-(3-iodo-6-oxo-cyclohexa-2,4-dien-1-ylidene)methyl]amino]butyl]benzamide CAS Name: 2-hydroxy-N-[4-[[(E)-(3-iodo-6-oxo-1-cyclohexa-2,4-dienylidene)methyl]amino]butyl]benzamide IUPAC Name: 2-hydroxy-N-[4-[[(E)-(3-iodo-6-oxocyclohexa-2,4-dien-1-ylidene)methyl]amino]butyl]benzamide Traditional Name: 2-hydroxy-N-[4-[[(E)-(3-iodo-6-keto-cyclohexa-2,4-dien-1-ylidene)methyl]amino]butyl]benzamide Formula: C18H19IN2O3 MolecularWeight: 438.25953

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)C(=O)NCCCCNC=C2C=C(C=CC2=O)I)O

Isomeric SMILES

C1=CC=C(C(=C1)C(=O)NCCCCN/C=C/2\C=C(C=CC2=O)I)O

InChI

InChI=1S/C18H19IN2O3/c19-14-7-8-16(22)13(11-14)12-20-9-3-4-10-21-18(24)15-5-1-2-6-17(15)23/h1-2,5-8,11-12,20,23H,3-4,9-10H2,(H,21,24)/b13-12+