2,4-bis(methylsulfonyl)-N-pentan-3-yl-aniline

Systemtic Name: 2,4-bis(methylsulfonyl)-N-pentan-3-yl-aniline Openeye Name: N-(1-ethylpropyl)-2,4-bis(methylsulfonyl)aniline CAS Name: 2,4-bis(methylsulfonyl)-N-pentan-3-ylaniline IUPAC Name: 2,4-bis(methylsulfonyl)-N-pentan-3-ylaniline Traditional Name: (2,4-dimesylphenyl)-(1-ethylpropyl)amine Formula: C13H21NO4S2 MolecularWeight: 319.44014

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CC)NC1=C(C=C(C=C1)S(=O)(=O)C)S(=O)(=O)C

Isomeric SMILES

CCC(CC)NC1=C(C=C(C=C1)S(=O)(=O)C)S(=O)(=O)C

InChI

InChI=1S/C13H21NO4S2/c1-5-10(6-2)14-12-8-7-11(19(3,15)16)9-13(12)20(4,17)18/h7-10,14H,5-6H2,1-4H3