[3-(azocan-1-ylsulfonyl)phenyl]methylazanium

Systemtic Name: [3-(azocan-1-ylsulfonyl)phenyl]methylazanium Openeye Name: [3-(azocan-1-ylsulfonyl)phenyl]methylammonium CAS Name: [3-(1-azocanylsulfonyl)phenyl]methylammonium IUPAC Name: [3-(azocan-1-ylsulfonyl)phenyl]methylazanium Traditional Name: [3-(azocan-1-ylsulfonyl)benzyl]ammonium Formula: C14H23N2O2S+ MolecularWeight: 283.40962

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)S(=O)(=O)C2=CC=CC(=C2)C[NH3+]

Isomeric SMILES

C1CCCN(CCC1)S(=O)(=O)C2=CC=CC(=C2)C[NH3+]

InChI

InChI=1S/C14H22N2O2S/c15-12-13-7-6-8-14(11-13)19(17,18)16-9-4-2-1-3-5-10-16/h6-8,11H,1-5,9-10,12,15H2/p+1