N-phenethyl-3-[4-(2-propan-2-ylindolizin-1-yl)sulfonylphenoxy]propan-1-amine hydrochloride

Systemtic Name: N-phenethyl-3-[4-(2-propan-2-ylindolizin-1-yl)sulfonylphenoxy]propan-1-amine hydrochloride Openeye Name: 3-[4-(2-isopropylindolizin-1-yl)sulfonylphenoxy]-N-phenethyl-propan-1-amine hydrochloride CAS Name: N-phenethyl-3-[4-[(2-propan-2-yl-1-indolizinyl)sulfonyl]phenoxy]-1-propanamine hydrochloride IUPAC Name: N-phenethyl-3-[4-(2-propan-2-ylindolizin-1-yl)sulfonylphenoxy]propan-1-amine hydrochloride Traditional Name: 3-[4-(2-isopropylindolizin-1-yl)sulfonylphenoxy]propyl-phenethyl-amine hydrochloride Formula: C28H33ClN2O3S MolecularWeight: 513.09122

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CN2C=CC=CC2=C1S(=O)(=O)C3=CC=C(C=C3)OCCCNCCC4=CC=CC=C4.Cl

Isomeric SMILES

CC(C)C1=CN2C=CC=CC2=C1S(=O)(=O)C3=CC=C(C=C3)OCCCNCCC4=CC=CC=C4.Cl

InChI

InChI=1S/C28H32N2O3S.ClH/c1-22(2)26-21-30-19-7-6-11-27(30)28(26)34(31,32)25-14-12-24(13-15-25)33-20-8-17-29-18-16-23-9-4-3-5-10-23;/h3-7,9-15,19,21-22,29H,8,16-18,20H2,1-2H3;1H