2-(6,9-dioxaspiro[4.4]nonan-8-ylmethylsulfanyl)-5-methyl-aniline

Systemtic Name: 2-(6,9-dioxaspiro[4.4]nonan-8-ylmethylsulfanyl)-5-methyl-aniline Openeye Name: 2-(6,9-dioxaspiro[4.4]nonan-8-ylmethylsulfanyl)-5-methyl-aniline CAS Name: 2-(6,9-dioxaspiro[4.4]nonan-8-ylmethylthio)-5-methylaniline IUPAC Name: 2-(6,9-dioxaspiro[4.4]nonan-8-ylmethylsulfanyl)-5-methylaniline Traditional Name: [2-(6,9-dioxaspiro[4.4]nonan-8-ylmethylthio)-5-methyl-phenyl]amine Formula: C15H21NO2S MolecularWeight: 279.39774

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)SCC2COC3(O2)CCCC3)N

Isomeric SMILES

CC1=CC(=C(C=C1)SCC2COC3(O2)CCCC3)N

InChI

InChI=1S/C15H21NO2S/c1-11-4-5-14(13(16)8-11)19-10-12-9-17-15(18-12)6-2-3-7-15/h4-5,8,12H,2-3,6-7,9-10,16H2,1H3