aniline; ethane; 3-methylbenzenesulfonic acid

Systemtic Name: aniline; ethane; 3-methylbenzenesulfonic acid Openeye Name: aniline; ethane; 3-methylbenzenesulfonic acid CAS Name: aniline; ethane; 3-methylbenzenesulfonic acid IUPAC Name: aniline; ethane; 3-methylbenzenesulfonic acid Traditional Name: ethane; 3-methylbesylic acid; phenylamine Formula: C15H21NO3S MolecularWeight: 295.39714

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C7H8O3S.C6H7N.C2H6/c1-6-3-2-4-7(5-6)11(8,9)10;7-6-4-2-1-3-5-6;1-2/h2-5H,1H3,(H,8,9,10);1-5H,7H2;1-2H3