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

Systemtic Name: 6-[1-[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazinyl]ethylidene]cyclohexa-2,4-dien-1-one Openeye Name: 6-[1-[2-(2-nitro-4-pyrrolidin-1-ylsulfonyl-phenyl)hydrazino]ethylidene]cyclohexa-2,4-dien-1-one CAS Name: 6-[1-[[2-nitro-4-(1-pyrrolidinylsulfonyl)phenyl]hydrazo]ethylidene]-1-cyclohexa-2,4-dienone IUPAC Name: 6-[1-[2-(2-nitro-4-pyrrolidin-1-ylsulfonylphenyl)hydrazinyl]ethylidene]cyclohexa-2,4-dien-1-one Traditional Name: 6-[1-[N'-(2-nitro-4-pyrrolidinosulfonyl-phenyl)hydrazino]ethylidene]cyclohexa-2,4-dien-1-one Formula: C18H20N4O5S MolecularWeight: 404.4402

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C1C=CC=CC1=O)NNC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

Isomeric SMILES

CC(=C1C=CC=CC1=O)NNC2=C(C=C(C=C2)S(=O)(=O)N3CCCC3)[N+](=O)[O-]

InChI

InChI=1S/C18H20N4O5S/c1-13(15-6-2-3-7-18(15)23)19-20-16-9-8-14(12-17(16)22(24)25)28(26,27)21-10-4-5-11-21/h2-3,6-9,12,19-20H,4-5,10-11H2,1H3