N-butyl-N-[3-[4-(2-ethylindolizin-1-yl)sulfonyl-2-methyl-phenoxy]propyl]butan-1-amine

Systemtic Name: N-butyl-N-[3-[4-(2-ethylindolizin-1-yl)sulfonyl-2-methyl-phenoxy]propyl]butan-1-amine Openeye Name: N-butyl-N-[3-[4-(2-ethylindolizin-1-yl)sulfonyl-2-methyl-phenoxy]propyl]butan-1-amine CAS Name: N-butyl-N-[3-[4-[(2-ethyl-1-indolizinyl)sulfonyl]-2-methylphenoxy]propyl]-1-butanamine IUPAC Name: N-butyl-N-[3-[4-(2-ethylindolizin-1-yl)sulfonyl-2-methylphenoxy]propyl]butan-1-amine Traditional Name: dibutyl-[3-[4-(2-ethylindolizin-1-yl)sulfonyl-2-methyl-phenoxy]propyl]amine Formula: C28H40N2O3S MolecularWeight: 484.6938

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCOC1=C(C=C(C=C1)S(=O)(=O)C2=C3C=CC=CN3C=C2CC)C

Isomeric SMILES

CCCCN(CCCC)CCCOC1=C(C=C(C=C1)S(=O)(=O)C2=C3C=CC=CN3C=C2CC)C

InChI

InChI=1S/C28H40N2O3S/c1-5-8-16-29(17-9-6-2)18-12-20-33-27-15-14-25(21-23(27)4)34(31,32)28-24(7-3)22-30-19-11-10-13-26(28)30/h10-11,13-15,19,21-22H,5-9,12,16-18,20H2,1-4H3