3-(methylsulfonylmethyl)-4-pentoxy-aniline

Systemtic Name: 3-(methylsulfonylmethyl)-4-pentoxy-aniline Openeye Name: 3-(methylsulfonylmethyl)-4-pentoxy-aniline CAS Name: 3-(methylsulfonylmethyl)-4-pentoxyaniline IUPAC Name: 3-(methylsulfonylmethyl)-4-pentoxyaniline Traditional Name: [4-amoxy-3-(mesylmethyl)phenyl]amine Formula: C13H21NO3S MolecularWeight: 271.37574

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCOC1=C(C=C(C=C1)N)CS(=O)(=O)C

Isomeric SMILES

CCCCCOC1=C(C=C(C=C1)N)CS(=O)(=O)C

InChI

InChI=1S/C13H21NO3S/c1-3-4-5-8-17-13-7-6-12(14)9-11(13)10-18(2,15)16/h6-7,9H,3-5,8,10,14H2,1-2H3