2-chloranyl-N-heptan-2-yl-5-methylsulfonyl-aniline

Systemtic Name: 2-chloranyl-N-heptan-2-yl-5-methylsulfonyl-aniline Openeye Name: 2-chloro-N-(1-methylhexyl)-5-methylsulfonyl-aniline CAS Name: 2-chloro-N-heptan-2-yl-5-methylsulfonylaniline IUPAC Name: 2-chloro-N-heptan-2-yl-5-methylsulfonylaniline Traditional Name: (2-chloro-5-mesyl-phenyl)-(1-methylhexyl)amine Formula: C14H22ClNO2S MolecularWeight: 303.84798

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC(C)NC1=C(C=CC(=C1)S(=O)(=O)C)Cl

Isomeric SMILES

CCCCCC(C)NC1=C(C=CC(=C1)S(=O)(=O)C)Cl

InChI

InChI=1S/C14H22ClNO2S/c1-4-5-6-7-11(2)16-14-10-12(19(3,17)18)8-9-13(14)15/h8-11,16H,4-7H2,1-3H3