N-butyl-N-[3-[4-(2-propylindolizin-1-yl)sulfonylphenoxy]propyl]butan-1-amine

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

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCOC1=CC=C(C=C1)S(=O)(=O)C2=C3C=CC=CN3C=C2CCC

Isomeric SMILES

CCCCN(CCCC)CCCOC1=CC=C(C=C1)S(=O)(=O)C2=C3C=CC=CN3C=C2CCC

InChI

InChI=1S/C28H40N2O3S/c1-4-7-18-29(19-8-5-2)20-11-22-33-25-14-16-26(17-15-25)34(31,32)28-24(12-6-3)23-30-21-10-9-13-27(28)30/h9-10,13-17,21,23H,4-8,11-12,18-20,22H2,1-3H3