N-butyl-N-[2-[4-(2-ethylindolizin-1-yl)sulfonylphenoxy]ethyl]butan-1-amine hydrochloride

Systemtic Name: N-butyl-N-[2-[4-(2-ethylindolizin-1-yl)sulfonylphenoxy]ethyl]butan-1-amine hydrochloride Openeye Name: N-butyl-N-[2-[4-(2-ethylindolizin-1-yl)sulfonylphenoxy]ethyl]butan-1-amine hydrochloride CAS Name: N-butyl-N-[2-[4-[(2-ethyl-1-indolizinyl)sulfonyl]phenoxy]ethyl]-1-butanamine hydrochloride IUPAC Name: N-butyl-N-[2-[4-(2-ethylindolizin-1-yl)sulfonylphenoxy]ethyl]butan-1-amine hydrochloride Traditional Name: dibutyl-[2-[4-(2-ethylindolizin-1-yl)sulfonylphenoxy]ethyl]amine hydrochloride Formula: C26H37ClN2O3S MolecularWeight: 493.10158

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCOC1=CC=C(C=C1)S(=O)(=O)C2=C3C=CC=CN3C=C2CC.Cl

Isomeric SMILES

CCCCN(CCCC)CCOC1=CC=C(C=C1)S(=O)(=O)C2=C3C=CC=CN3C=C2CC.Cl

InChI

InChI=1S/C26H36N2O3S.ClH/c1-4-7-16-27(17-8-5-2)19-20-31-23-12-14-24(15-13-23)32(29,30)26-22(6-3)21-28-18-10-9-11-25(26)28;/h9-15,18,21H,4-8,16-17,19-20H2,1-3H3;1H