3,4-dimethoxy-N-[3-[4-(2-propan-2-ylindolizin-1-yl)sulfonylphenoxy]propyl]aniline hydrochloride

Systemtic Name: 3,4-dimethoxy-N-[3-[4-(2-propan-2-ylindolizin-1-yl)sulfonylphenoxy]propyl]aniline hydrochloride Openeye Name: N-[3-[4-(2-isopropylindolizin-1-yl)sulfonylphenoxy]propyl]-3,4-dimethoxy-aniline hydrochloride CAS Name: 3,4-dimethoxy-N-[3-[4-[(2-propan-2-yl-1-indolizinyl)sulfonyl]phenoxy]propyl]aniline hydrochloride IUPAC Name: 3,4-dimethoxy-N-[3-[4-(2-propan-2-ylindolizin-1-yl)sulfonylphenoxy]propyl]aniline hydrochloride Traditional Name: (3,4-dimethoxyphenyl)-[3-[4-(2-isopropylindolizin-1-yl)sulfonylphenoxy]propyl]amine hydrochloride Formula: C28H33ClN2O5S MolecularWeight: 545.09002

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=CN2C=CC=CC2=C1S(=O)(=O)C3=CC=C(C=C3)OCCCNC4=CC(=C(C=C4)OC)OC.Cl

Isomeric SMILES

CC(C)C1=CN2C=CC=CC2=C1S(=O)(=O)C3=CC=C(C=C3)OCCCNC4=CC(=C(C=C4)OC)OC.Cl

InChI

InChI=1S/C28H32N2O5S.ClH/c1-20(2)24-19-30-16-6-5-8-25(30)28(24)36(31,32)23-12-10-22(11-13-23)35-17-7-15-29-21-9-14-26(33-3)27(18-21)34-4;/h5-6,8-14,16,18-20,29H,7,15,17H2,1-4H3;1H