N-[[4-(2-ethylsulfonylethoxy)-3,5-dimethyl-phenyl]methyl]propan-1-amine

Systemtic Name: N-[[4-(2-ethylsulfonylethoxy)-3,5-dimethyl-phenyl]methyl]propan-1-amine Openeye Name: N-[[4-(2-ethylsulfonylethoxy)-3,5-dimethyl-phenyl]methyl]propan-1-amine CAS Name: N-[[4-(2-ethylsulfonylethoxy)-3,5-dimethylphenyl]methyl]-1-propanamine IUPAC Name: N-[[4-(2-ethylsulfonylethoxy)-3,5-dimethylphenyl]methyl]propan-1-amine Traditional Name: [4-(2-esylethoxy)-3,5-dimethyl-benzyl]-propyl-amine Formula: C16H27NO3S MolecularWeight: 313.45548

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Descriptors Computed from Structure

Canonical SMILES:

CCCNCC1=CC(=C(C(=C1)C)OCCS(=O)(=O)CC)C

Isomeric SMILES

CCCNCC1=CC(=C(C(=C1)C)OCCS(=O)(=O)CC)C

InChI

InChI=1S/C16H27NO3S/c1-5-7-17-12-15-10-13(3)16(14(4)11-15)20-8-9-21(18,19)6-2/h10-11,17H,5-9,12H2,1-4H3