2-azido-N-[(E)-1-(cyclohexylamino)-1-oxidanyl-3-oxidanylidene-3-phenyl-prop-1-en-2-yl]-N-[(4-fluorophenyl)methyl]benzamide

Systemtic Name: 2-azido-N-[(E)-1-(cyclohexylamino)-1-oxidanyl-3-oxidanylidene-3-phenyl-prop-1-en-2-yl]-N-[(4-fluorophenyl)methyl]benzamide Openeye Name: 2-azido-N-[(E)-1-benzoyl-2-(cyclohexylamino)-2-hydroxy-vinyl]-N-[(4-fluorophenyl)methyl]benzamide CAS Name: 2-azido-N-[(E)-1-(cyclohexylamino)-1-hydroxy-3-oxo-3-phenylprop-1-en-2-yl]-N-[(4-fluorophenyl)methyl]benzamide IUPAC Name: 2-azido-N-[(E)-1-(cyclohexylamino)-1-hydroxy-3-oxo-3-phenylprop-1-en-2-yl]-N-[(4-fluorophenyl)methyl]benzamide Traditional Name: 2-azido-N-[(E)-1-benzoyl-2-(cyclohexylamino)-2-hydroxy-vinyl]-N-(4-fluorobenzyl)benzamide Formula: C29H28FN5O3 MolecularWeight: 513.562723

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)NC(=C(C(=O)C2=CC=CC=C2)N(CC3=CC=C(C=C3)F)C(=O)C4=CC=CC=C4N=[N+]=[N-])O

Isomeric SMILES

C1CCC(CC1)N/C(=C(/C(=O)C2=CC=CC=C2)\N(CC3=CC=C(C=C3)F)C(=O)C4=CC=CC=C4N=[N+]=[N-])/O

InChI

InChI=1S/C29H28FN5O3/c30-22-17-15-20(16-18-22)19-35(29(38)24-13-7-8-14-25(24)33-34-31)26(27(36)21-9-3-1-4-10-21)28(37)32-23-11-5-2-6-12-23/h1,3-4,7-10,13-18,23,32,37H,2,5-6,11-12,19H2/b28-26+