[4-(azepan-1-ylsulfonyl)-3-nitro-phenyl]diazane

Systemtic Name: [4-(azepan-1-ylsulfonyl)-3-nitro-phenyl]diazane Openeye Name: [4-(azepan-1-ylsulfonyl)-3-nitro-phenyl]hydrazine CAS Name: [4-(1-azepanylsulfonyl)-3-nitrophenyl]hydrazine IUPAC Name: [4-(azepan-1-ylsulfonyl)-3-nitrophenyl]hydrazine Traditional Name: [4-(azepan-1-ylsulfonyl)-3-nitro-phenyl]hydrazine Formula: C12H18N4O4S MolecularWeight: 314.36072

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)NN)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CC1)S(=O)(=O)C2=C(C=C(C=C2)NN)[N+](=O)[O-]

InChI

InChI=1S/C12H18N4O4S/c13-14-10-5-6-12(11(9-10)16(17)18)21(19,20)15-7-3-1-2-4-8-15/h5-6,9,14H,1-4,7-8,13H2