[2-methyl-5-[(phenylmethyl)amino]phenyl]arsonic acid

Systemtic Name: [2-methyl-5-[(phenylmethyl)amino]phenyl]arsonic acid Openeye Name: [5-(benzylamino)-2-methyl-phenyl]arsonic acid CAS Name: [2-methyl-5-[(phenylmethyl)amino]phenyl]arsonic acid IUPAC Name: [5-(benzylamino)-2-methylphenyl]arsonic acid Traditional Name: [5-(benzylamino)-2-methyl-phenyl]arsonic acid Formula: C14H16AsNO3 MolecularWeight: 321.20334

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)NCC2=CC=CC=C2)[As](=O)(O)O

Isomeric SMILES

CC1=C(C=C(C=C1)NCC2=CC=CC=C2)[As](=O)(O)O

InChI

InChI=1S/C14H16AsNO3/c1-11-7-8-13(9-14(11)15(17,18)19)16-10-12-5-3-2-4-6-12/h2-9,16H,10H2,1H3,(H2,17,18,19)