4-(2-propylindolizin-4-ium-4-yl)sulfonylphenol

Systemtic Name: 4-(2-propylindolizin-4-ium-4-yl)sulfonylphenol Openeye Name: 4-(2-propylindolizin-4-ium-4-yl)sulfonylphenol CAS Name: 4-[(2-propyl-4-indolizin-4-iumyl)sulfonyl]phenol IUPAC Name: 4-(2-propylindolizin-4-ium-4-yl)sulfonylphenol Traditional Name: 4-(2-propylindolizin-4-ium-4-yl)sulfonylphenol Formula: C17H18NO3S+ MolecularWeight: 316.39472

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C[N+]2(C=CC=CC2=C1)S(=O)(=O)C3=CC=C(C=C3)O

Isomeric SMILES

CCCC1=C[N+]2(C=CC=CC2=C1)S(=O)(=O)C3=CC=C(C=C3)O

InChI

InChI=1S/C17H17NO3S/c1-2-5-14-12-15-6-3-4-11-18(15,13-14)22(20,21)17-9-7-16(19)8-10-17/h3-4,6-13H,2,5H2,1H3/p+1