4-[4-(3-methylphenoxy)phenoxy]butan-2-ylsulfanylcarbamic acid

Systemtic Name: 4-[4-(3-methylphenoxy)phenoxy]butan-2-ylsulfanylcarbamic acid Openeye Name: [1-methyl-3-[4-(3-methylphenoxy)phenoxy]propyl]sulfanylcarbamic acid CAS Name: [4-[4-(3-methylphenoxy)phenoxy]butan-2-ylthio]carbamic acid IUPAC Name: 4-[4-(3-methylphenoxy)phenoxy]butan-2-ylsulfanylcarbamic acid Traditional Name: [[1-methyl-3-[4-(3-methylphenoxy)phenoxy]propyl]thio]carbamic acid Formula: C18H21NO4S MolecularWeight: 347.42864

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OC2=CC=C(C=C2)OCCC(C)SNC(=O)O

Isomeric SMILES

CC1=CC(=CC=C1)OC2=CC=C(C=C2)OCCC(C)SNC(=O)O

InChI

InChI=1S/C18H21NO4S/c1-13-4-3-5-17(12-13)23-16-8-6-15(7-9-16)22-11-10-14(2)24-19-18(20)21/h3-9,12,14,19H,10-11H2,1-2H3,(H,20,21)