[2,3-bis(chloranyl)-4-(2-phenylpropanoylamino)phenyl] thiocyanate

Systemtic Name: [2,3-bis(chloranyl)-4-(2-phenylpropanoylamino)phenyl] thiocyanate Openeye Name: [2,3-dichloro-4-(2-phenylpropanoylamino)phenyl] thiocyanate CAS Name: thiocyanic acid [2,3-dichloro-4-[(1-oxo-2-phenylpropyl)amino]phenyl] ester IUPAC Name: [2,3-dichloro-4-(2-phenylpropanoylamino)phenyl] thiocyanate Traditional Name: thiocyanic acid [2,3-dichloro-4-(hydratropoylamino)phenyl] ester Formula: C16H12Cl2N2OS MolecularWeight: 351.25028

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=CC=C1)C(=O)NC2=C(C(=C(C=C2)SC#N)Cl)Cl

Isomeric SMILES

CC(C1=CC=CC=C1)C(=O)NC2=C(C(=C(C=C2)SC#N)Cl)Cl

InChI

InChI=1S/C16H12Cl2N2OS/c1-10(11-5-3-2-4-6-11)16(21)20-12-7-8-13(22-9-19)15(18)14(12)17/h2-8,10H,1H3,(H,20,21)