7-(3-aminophenyl)heptane-1-sulfonic acid

Systemtic Name: 7-(3-aminophenyl)heptane-1-sulfonic acid Openeye Name: 7-(3-aminophenyl)heptane-1-sulfonic acid CAS Name: 7-(3-aminophenyl)-1-heptanesulfonic acid IUPAC Name: 7-(3-aminophenyl)heptane-1-sulfonic acid Traditional Name: 7-(3-aminophenyl)heptane-1-sulfonic acid Formula: C13H21NO3S MolecularWeight: 271.37574

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)N)CCCCCCCS(=O)(=O)O

Isomeric SMILES

C1=CC(=CC(=C1)N)CCCCCCCS(=O)(=O)O

InChI

InChI=1S/C13H21NO3S/c14-13-9-6-8-12(11-13)7-4-2-1-3-5-10-18(15,16)17/h6,8-9,11H,1-5,7,10,14H2,(H,15,16,17)