4-[3-[5-(4-methoxyphenyl)pentan-2-ylamino]-2-oxidanyl-propoxy]-2-methylsulfinyl-phenol

Systemtic Name: 4-[3-[5-(4-methoxyphenyl)pentan-2-ylamino]-2-oxidanyl-propoxy]-2-methylsulfinyl-phenol Openeye Name: 4-[2-hydroxy-3-[[4-(4-methoxyphenyl)-1-methyl-butyl]amino]propoxy]-2-methylsulfinyl-phenol CAS Name: 4-[2-hydroxy-3-[5-(4-methoxyphenyl)pentan-2-ylamino]propoxy]-2-methylsulfinylphenol IUPAC Name: 4-[2-hydroxy-3-[5-(4-methoxyphenyl)pentan-2-ylamino]propoxy]-2-methylsulfinylphenol Traditional Name: 4-[2-hydroxy-3-[[4-(4-methoxyphenyl)-1-methyl-butyl]amino]propoxy]-2-methylsulfinyl-phenol Formula: C22H31NO5S MolecularWeight: 421.55024

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCCC1=CC=C(C=C1)OC)NCC(COC2=CC(=C(C=C2)O)S(=O)C)O

Isomeric SMILES

CC(CCCC1=CC=C(C=C1)OC)NCC(COC2=CC(=C(C=C2)O)S(=O)C)O

InChI

InChI=1S/C22H31NO5S/c1-16(5-4-6-17-7-9-19(27-2)10-8-17)23-14-18(24)15-28-20-11-12-21(25)22(13-20)29(3)26/h7-13,16,18,23-25H,4-6,14-15H2,1-3H3