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

Systemtic Name: N-butyl-N-[3-[4-[(2-phenyl-1-benzofuran-3-yl)sulfonyl]phenoxy]propyl]butan-1-amine Openeye Name: N-butyl-N-[3-[4-(2-phenylbenzofuran-3-yl)sulfonylphenoxy]propyl]butan-1-amine CAS Name: N-butyl-N-[3-[4-[(2-phenyl-3-benzofuranyl)sulfonyl]phenoxy]propyl]-1-butanamine IUPAC Name: N-butyl-N-[3-[4-[(2-phenyl-1-benzofuran-3-yl)sulfonyl]phenoxy]propyl]butan-1-amine Traditional Name: dibutyl-[3-[4-(2-phenylbenzofuran-3-yl)sulfonylphenoxy]propyl]amine Formula: C31H37NO4S MolecularWeight: 519.69478

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CCCC)CCCOC1=CC=C(C=C1)S(=O)(=O)C2=C(OC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CCCCN(CCCC)CCCOC1=CC=C(C=C1)S(=O)(=O)C2=C(OC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C31H37NO4S/c1-3-5-21-32(22-6-4-2)23-12-24-35-26-17-19-27(20-18-26)37(33,34)31-28-15-10-11-16-29(28)36-30(31)25-13-8-7-9-14-25/h7-11,13-20H,3-6,12,21-24H2,1-2H3