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2-nitro-N-(16-oxidanylidene-1-azacyclohexadec-5-yl)benzenesulfonamide

2-nitro-N-(16-oxidanylidene-1-azacyclohexadec-5-yl)benzenesulfonamide

Systemtic Name:2-nitro-N-(16-oxidanylidene-1-azacyclohexadec-5-yl)benzenesulfonamide
Openeye Name:2-nitro-N-(16-oxo-azacyclohexadec-5-yl)benzenesulfonamide
CAS Name:2-nitro-N-(16-oxo-azacyclohexadec-5-yl)benzenesulfonamide
IUPAC Name:2-nitro-N-(16-oxo-azacyclohexadec-5-yl)benzenesulfonamide
Traditional Name:N-(16-keto-azacyclohexadec-5-yl)-2-nitro-benzenesulfonamide
Formula: C21H33N3O5S
MolecularWeight: 439.56882
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Descriptors Computed from Structure

Canonical SMILES:

C1CCCCCC(=O)NCCCC(CCCC1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]


Isomeric SMILES

C1CCCCCC(=O)NCCCC(CCCC1)NS(=O)(=O)C2=CC=CC=C2[N+](=O)[O-]


InChI

InChI=1S/C21H33N3O5S/c25-21-16-8-6-4-2-1-3-5-7-12-18(13-11-17-22-21)23-30(28,29)20-15-10-9-14-19(20)24(26)27/h9-10,14-15,18,23H,1-8,11-13,16-17H2,(H,22,25)


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