(6E)-4-nitro-6-[[(4-pyrrolidin-1-ylsulfonylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: (6E)-4-nitro-6-[[(4-pyrrolidin-1-ylsulfonylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: (6E)-4-nitro-6-[(4-pyrrolidin-1-ylsulfonylanilino)methylene]cyclohexa-2,4-dien-1-one CAS Name: (6E)-4-nitro-6-[[4-(1-pyrrolidinylsulfonyl)anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: (6E)-4-nitro-6-[(4-pyrrolidin-1-ylsulfonylanilino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: (6E)-4-nitro-6-[(4-pyrrolidinosulfonylanilino)methylene]cyclohexa-2,4-dien-1-one Formula: C17H17N3O5S MolecularWeight: 375.39898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)NC=C3C=C(C=CC3=O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=C(C=C2)N/C=C/3\C=C(C=CC3=O)[N+](=O)[O-]

InChI

InChI=1S/C17H17N3O5S/c21-17-8-5-15(20(22)23)11-13(17)12-18-14-3-6-16(7-4-14)26(24,25)19-9-1-2-10-19/h3-8,11-12,18H,1-2,9-10H2/b13-12+