4-(azocan-1-ylsulfonyl)-2-nitro-phenol

Systemtic Name: 4-(azocan-1-ylsulfonyl)-2-nitro-phenol Openeye Name: 4-(azocan-1-ylsulfonyl)-2-nitro-phenol CAS Name: 4-(1-azocanylsulfonyl)-2-nitrophenol IUPAC Name: 4-(azocan-1-ylsulfonyl)-2-nitrophenol Traditional Name: 4-(azocan-1-ylsulfonyl)-2-nitro-phenol Formula: C13H18N2O5S MolecularWeight: 314.35742

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

Isomeric SMILES

C1CCCN(CCC1)S(=O)(=O)C2=CC(=C(C=C2)O)[N+](=O)[O-]

InChI

InChI=1S/C13H18N2O5S/c16-13-7-6-11(10-12(13)15(17)18)21(19,20)14-8-4-2-1-3-5-9-14/h6-7,10,16H,1-5,8-9H2