1-[(phenylmethyl)amino]ethanesulfonic acid

Systemtic Name: 1-[(phenylmethyl)amino]ethanesulfonic acid Openeye Name: 1-(benzylamino)ethanesulfonic acid CAS Name: 1-[(phenylmethyl)amino]ethanesulfonic acid IUPAC Name: 1-(benzylamino)ethanesulfonic acid Traditional Name: 1-(benzylamino)ethanesulfonic acid Formula: C9H13NO3S MolecularWeight: 215.26942

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Descriptors Computed from Structure

Canonical SMILES:

CC(NCC1=CC=CC=C1)S(=O)(=O)O

Isomeric SMILES

CC(NCC1=CC=CC=C1)S(=O)(=O)O

InChI

InChI=1S/C9H13NO3S/c1-8(14(11,12)13)10-7-9-5-3-2-4-6-9/h2-6,8,10H,7H2,1H3,(H,11,12,13)