cyanomethylcarbamoyl(phenethyl)carbamic acid

Systemtic Name: cyanomethylcarbamoyl(phenethyl)carbamic acid Openeye Name: cyanomethylcarbamoyl(phenethyl)carbamic acid CAS Name: [(cyanomethylamino)-oxomethyl]-phenethylcarbamic acid IUPAC Name: cyanomethylcarbamoyl(phenethyl)carbamic acid Traditional Name: cyanomethylcarbamoyl(phenethyl)carbamic acid Formula: C12H13N3O3 MolecularWeight: 247.24992

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCN(C(=O)NCC#N)C(=O)O

Isomeric SMILES

C1=CC=C(C=C1)CCN(C(=O)NCC#N)C(=O)O

InChI

InChI=1S/C12H13N3O3/c13-7-8-14-11(16)15(12(17)18)9-6-10-4-2-1-3-5-10/h1-5H,6,8-9H2,(H,14,16)(H,17,18)