3-(cyanomethylamino)-2-methyl-benzoic acid

Systemtic Name: 3-(cyanomethylamino)-2-methyl-benzoic acid Openeye Name: 3-(cyanomethylamino)-2-methyl-benzoic acid CAS Name: 3-(cyanomethylamino)-2-methylbenzoic acid IUPAC Name: 3-(cyanomethylamino)-2-methylbenzoic acid Traditional Name: 3-(cyanomethylamino)-2-methyl-benzoic acid Formula: C10H10N2O2 MolecularWeight: 190.1986

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC=C1NCC#N)C(=O)O

Isomeric SMILES

CC1=C(C=CC=C1NCC#N)C(=O)O

InChI

InChI=1S/C10H10N2O2/c1-7-8(10(13)14)3-2-4-9(7)12-6-5-11/h2-4,12H,6H2,1H3,(H,13,14)