3-[(1R,3Z)-3-[(4-methylphenyl)sulfonylhydrazinylidene]-1-phenyl-pentyl]-4-oxidanylidene-chromen-2-olate

Systemtic Name: 3-[(1R,3Z)-3-[(4-methylphenyl)sulfonylhydrazinylidene]-1-phenyl-pentyl]-4-oxidanylidene-chromen-2-olate Openeye Name: 4-oxo-3-[(1R,3Z)-1-phenyl-3-(p-tolylsulfonylhydrazono)pentyl]chromen-2-olate CAS Name: 3-[(1R,3Z)-3-[(4-methylphenyl)sulfonylhydrazinylidene]-1-phenylpentyl]-4-oxo-1-benzopyran-2-olate IUPAC Name: 3-[(1R,3Z)-3-[(4-methylphenyl)sulfonylhydrazinylidene]-1-phenylpentyl]-4-oxochromen-2-olate Traditional Name: 4-keto-3-[(1R,3Z)-1-phenyl-3-(tosylhydrazono)pentyl]chromen-2-olate Formula: C27H25N2O5S- MolecularWeight: 489.5628

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNS(=O)(=O)C1=CC=C(C=C1)C)CC(C2=CC=CC=C2)C3=C(OC4=CC=CC=C4C3=O)[O-]

Isomeric SMILES

CC/C(=N/NS(=O)(=O)C1=CC=C(C=C1)C)/C[C@H](C2=CC=CC=C2)C3=C(OC4=CC=CC=C4C3=O)[O-]

InChI

InChI=1S/C27H26N2O5S/c1-3-20(28-29-35(32,33)21-15-13-18(2)14-16-21)17-23(19-9-5-4-6-10-19)25-26(30)22-11-7-8-12-24(22)34-27(25)31/h4-16,23,29,31H,3,17H2,1-2H3/p-1/b28-20-/t23-/m1/s1