1-[phenethyl(phenyl)amino]butane-2-sulfonic acid

Systemtic Name: 1-[phenethyl(phenyl)amino]butane-2-sulfonic acid Openeye Name: 1-(N-phenethylanilino)butane-2-sulfonic acid CAS Name: 1-(N-phenethylanilino)-2-butanesulfonic acid IUPAC Name: 1-(N-phenethylanilino)butane-2-sulfonic acid Traditional Name: 1-(N-phenethylanilino)butane-2-sulfonic acid Formula: C18H23NO3S MolecularWeight: 333.44512

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Descriptors Computed from Structure

Canonical SMILES:

CCC(CN(CCC1=CC=CC=C1)C2=CC=CC=C2)S(=O)(=O)O

Isomeric SMILES

CCC(CN(CCC1=CC=CC=C1)C2=CC=CC=C2)S(=O)(=O)O

InChI

InChI=1S/C18H23NO3S/c1-2-18(23(20,21)22)15-19(17-11-7-4-8-12-17)14-13-16-9-5-3-6-10-16/h3-12,18H,2,13-15H2,1H3,(H,20,21,22)