3-(butylamino)-2-[(Z)-2-oxidanyl-2-phenyl-ethenyl]sulfonyl-1-phenyl-propan-1-one

Systemtic Name: 3-(butylamino)-2-[(Z)-2-oxidanyl-2-phenyl-ethenyl]sulfonyl-1-phenyl-propan-1-one Openeye Name: 3-(butylamino)-2-[(Z)-2-hydroxy-2-phenyl-vinyl]sulfonyl-1-phenyl-propan-1-one CAS Name: 3-(butylamino)-2-[(Z)-2-hydroxy-2-phenylethenyl]sulfonyl-1-phenyl-1-propanone IUPAC Name: 3-(butylamino)-2-[(Z)-2-hydroxy-2-phenylethenyl]sulfonyl-1-phenylpropan-1-one Traditional Name: 3-(butylamino)-2-[(Z)-2-hydroxy-2-phenyl-vinyl]sulfonyl-1-phenyl-propan-1-one Formula: C21H25NO4S MolecularWeight: 387.4925

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCNCC(C(=O)C1=CC=CC=C1)S(=O)(=O)C=C(C2=CC=CC=C2)O

Isomeric SMILES

CCCCNCC(C(=O)C1=CC=CC=C1)S(=O)(=O)/C=C(/C2=CC=CC=C2)\O

InChI

InChI=1S/C21H25NO4S/c1-2-3-14-22-15-20(21(24)18-12-8-5-9-13-18)27(25,26)16-19(23)17-10-6-4-7-11-17/h4-13,16,20,22-23H,2-3,14-15H2,1H3/b19-16-