N-(1,3-benzodioxol-4-ylmethyl)-2-methylsulfonyl-aniline

Systemtic Name: N-(1,3-benzodioxol-4-ylmethyl)-2-methylsulfonyl-aniline Openeye Name: N-(1,3-benzodioxol-4-ylmethyl)-2-methylsulfonyl-aniline CAS Name: N-(1,3-benzodioxol-4-ylmethyl)-2-methylsulfonylaniline IUPAC Name: N-(1,3-benzodioxol-4-ylmethyl)-2-methylsulfonylaniline Traditional Name: 1,3-benzodioxol-4-ylmethyl-(2-mesylphenyl)amine Formula: C15H15NO4S MolecularWeight: 305.3489

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Descriptors Computed from Structure

Canonical SMILES:

CS(=O)(=O)C1=CC=CC=C1NCC2=C3C(=CC=C2)OCO3

Isomeric SMILES

CS(=O)(=O)C1=CC=CC=C1NCC2=C3C(=CC=C2)OCO3

InChI

InChI=1S/C15H15NO4S/c1-21(17,18)14-8-3-2-6-12(14)16-9-11-5-4-7-13-15(11)20-10-19-13/h2-8,16H,9-10H2,1H3