2-fluoranyl-N-[3-[2-[(3-methoxy-4-oxidanylidene-5-prop-2-enyl-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-oxidanylidene-propyl]benzamide

Systemtic Name: 2-fluoranyl-N-[3-[2-[(3-methoxy-4-oxidanylidene-5-prop-2-enyl-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-oxidanylidene-propyl]benzamide Openeye Name: N-[3-[2-[(3-allyl-5-methoxy-4-oxo-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-3-oxo-propyl]-2-fluoro-benzamide CAS Name: 2-fluoro-N-[3-[(3-methoxy-4-oxo-5-prop-2-enyl-1-cyclohexa-2,5-dienylidene)methylhydrazo]-3-oxopropyl]benzamide IUPAC Name: 2-fluoro-N-[3-[2-[(3-methoxy-4-oxo-5-prop-2-enylcyclohexa-2,5-dien-1-ylidene)methyl]hydrazinyl]-3-oxopropyl]benzamide Traditional Name: N-[3-[N'-[(3-allyl-4-keto-5-methoxy-cyclohexa-2,5-dien-1-ylidene)methyl]hydrazino]-3-keto-propyl]-2-fluoro-benzamide Formula: C21H22FN3O4 MolecularWeight: 399.415483

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CNNC(=O)CCNC(=O)C2=CC=CC=C2F)C=C(C1=O)CC=C

Isomeric SMILES

COC1=CC(=CNNC(=O)CCNC(=O)C2=CC=CC=C2F)C=C(C1=O)CC=C

InChI

InChI=1S/C21H22FN3O4/c1-3-6-15-11-14(12-18(29-2)20(15)27)13-24-25-19(26)9-10-23-21(28)16-7-4-5-8-17(16)22/h3-5,7-8,11-13,24H,1,6,9-10H2,2H3,(H,23,28)(H,25,26)