N-butyl-N-[3-[4-(2-propan-2-ylfuran-3-yl)sulfonylphenoxy]propyl]butan-1-amine; ethanedioic acid

Systemtic Name: N-butyl-N-[3-[4-(2-propan-2-ylfuran-3-yl)sulfonylphenoxy]propyl]butan-1-amine; ethanedioic acid Openeye Name: N-butyl-N-[3-[4-[(2-isopropyl-3-furyl)sulfonyl]phenoxy]propyl]butan-1-amine; oxalic acid CAS Name: N-butyl-N-[3-[4-[(2-propan-2-yl-3-furanyl)sulfonyl]phenoxy]propyl]-1-butanamine; oxalic acid IUPAC Name: N-butyl-N-[3-[4-(2-propan-2-ylfuran-3-yl)sulfonylphenoxy]propyl]butan-1-amine; oxalic acid Traditional Name: dibutyl-[3-[4-[(2-isopropyl-3-furyl)sulfonyl]phenoxy]propyl]amine; oxalic acid Formula: C26H39NO8S MolecularWeight: 525.65476

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCOC1=CC=C(C=C1)S(=O)(=O)C2=C(OC=C2)C(C)C.C(=O)(C(=O)O)O

Isomeric SMILES

CCCCN(CCCC)CCCOC1=CC=C(C=C1)S(=O)(=O)C2=C(OC=C2)C(C)C.C(=O)(C(=O)O)O

InChI

InChI=1S/C24H37NO4S.C2H2O4/c1-5-7-15-25(16-8-6-2)17-9-18-28-21-10-12-22(13-11-21)30(26,27)23-14-19-29-24(23)20(3)4;3-1(4)2(5)6/h10-14,19-20H,5-9,15-18H2,1-4H3;(H,3,4)(H,5,6)