4-[1-[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinyl]propylidene]cyclohexa-2,5-dien-1-one

Systemtic Name: 4-[1-[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinyl]propylidene]cyclohexa-2,5-dien-1-one Openeye Name: 4-[1-[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazino]propylidene]cyclohexa-2,5-dien-1-one CAS Name: 4-[1-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]hydrazo]propylidene]-1-cyclohexa-2,5-dienone IUPAC Name: 4-[1-[2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)hydrazinyl]propylidene]cyclohexa-2,5-dien-1-one Traditional Name: 4-[1-[N'-(2-nitro-4-pyrrolidinosulfonyl-phenyl)hydrazino]propylidene]cyclohexa-2,5-dien-1-one Formula: C19H22N4O5S MolecularWeight: 418.46678

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=C1C=CC(=O)C=C1)NNC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CCC(=C1C=CC(=O)C=C1)NNC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C19H22N4O5S/c1-2-17(14-5-7-15(24)8-6-14)20-21-18-10-9-16(13-19(18)23(25)26)29(27,28)22-11-3-4-12-22/h5-10,13,20-21H,2-4,11-12H2,1H3