6-[[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinyl]methylidene]-3-propoxy-cyclohexa-2,4-dien-1-one

Systemtic Name: 6-[[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinyl]methylidene]-3-propoxy-cyclohexa-2,4-dien-1-one Openeye Name: 6-[[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazino]methylene]-3-propoxy-cyclohexa-2,4-dien-1-one CAS Name: 6-[[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]hydrazo]methylidene]-3-propoxy-1-cyclohexa-2,4-dienone IUPAC Name: 6-[[2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)hydrazinyl]methylidene]-3-propoxycyclohexa-2,4-dien-1-one Traditional Name: 6-[[N'-(2-nitro-4-pyrrolidinosulfonyl-phenyl)hydrazino]methylene]-3-propoxy-cyclohexa-2,4-dien-1-one Formula: C20H24N4O6S MolecularWeight: 448.49276

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC1=CC(=O)C(=CNNC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])C=C1

Isomeric SMILES

CCCOC1=CC(=O)C(=CNNC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-])C=C1

InChI

InChI=1S/C20H24N4O6S/c1-2-11-30-16-6-5-15(20(25)12-16)14-21-22-18-8-7-17(13-19(18)24(26)27)31(28,29)23-9-3-4-10-23/h5-8,12-14,21-22H,2-4,9-11H2,1H3