2-hexadecoxy-5-methylsulfonyl-aniline

Systemtic Name: 2-hexadecoxy-5-methylsulfonyl-aniline Openeye Name: 2-hexadecoxy-5-methylsulfonyl-aniline CAS Name: 2-hexadecoxy-5-methylsulfonylaniline IUPAC Name: 2-hexadecoxy-5-methylsulfonylaniline Traditional Name: (2-cetyloxy-5-mesyl-phenyl)amine Formula: C23H41NO3S MolecularWeight: 411.64154

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)C)N

Isomeric SMILES

CCCCCCCCCCCCCCCCOC1=C(C=C(C=C1)S(=O)(=O)C)N

InChI

InChI=1S/C23H41NO3S/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-19-27-23-18-17-21(20-22(23)24)28(2,25)26/h17-18,20H,3-16,19,24H2,1-2H3