2-(4-azanyl-4-oxidanylidene-butyl)-4-methyl-benzenesulfonic acid

Systemtic Name: 2-(4-azanyl-4-oxidanylidene-butyl)-4-methyl-benzenesulfonic acid Openeye Name: 2-(4-amino-4-oxo-butyl)-4-methyl-benzenesulfonic acid CAS Name: 2-(4-amino-4-oxobutyl)-4-methylbenzenesulfonic acid IUPAC Name: 2-(4-amino-4-oxobutyl)-4-methylbenzenesulfonic acid Traditional Name: 2-(4-amino-4-keto-butyl)-4-methyl-besylic acid Formula: C11H15NO4S MolecularWeight: 257.3061

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)S(=O)(=O)O)CCCC(=O)N

Isomeric SMILES

CC1=CC(=C(C=C1)S(=O)(=O)O)CCCC(=O)N

InChI

InChI=1S/C11H15NO4S/c1-8-5-6-10(17(14,15)16)9(7-8)3-2-4-11(12)13/h5-7H,2-4H2,1H3,(H2,12,13)(H,14,15,16)