4-chloranyl-2-nitro-6-[[(3-pyrrolidin-1-ylsulfonylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one

Systemtic Name: 4-chloranyl-2-nitro-6-[[(3-pyrrolidin-1-ylsulfonylphenyl)amino]methylidene]cyclohexa-2,4-dien-1-one Openeye Name: 4-chloro-2-nitro-6-[(3-pyrrolidin-1-ylsulfonylanilino)methylene]cyclohexa-2,4-dien-1-one CAS Name: 4-chloro-2-nitro-6-[[3-(1-pyrrolidinylsulfonyl)anilino]methylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 4-chloro-2-nitro-6-[(3-pyrrolidin-1-ylsulfonylanilino)methylidene]cyclohexa-2,4-dien-1-one Traditional Name: 4-chloro-2-nitro-6-[(3-pyrrolidinosulfonylanilino)methylene]cyclohexa-2,4-dien-1-one Formula: C17H16ClN3O5S MolecularWeight: 409.84404

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Cl

Isomeric SMILES

C1CCN(C1)S(=O)(=O)C2=CC=CC(=C2)NC=C3C=C(C=C(C3=O)[N+](=O)[O-])Cl

InChI

InChI=1S/C17H16ClN3O5S/c18-13-8-12(17(22)16(9-13)21(23)24)11-19-14-4-3-5-15(10-14)27(25,26)20-6-1-2-7-20/h3-5,8-11,19H,1-2,6-7H2