ethyl 2-azanyl-5-chloranyl-3-thiocyanato-benzoate

Systemtic Name: ethyl 2-azanyl-5-chloranyl-3-thiocyanato-benzoate Openeye Name: ethyl 2-amino-5-chloro-3-thiocyanato-benzoate CAS Name: 2-amino-5-chloro-3-thiocyanatobenzoic acid ethyl ester IUPAC Name: ethyl 2-amino-5-chloro-3-thiocyanatobenzoate Traditional Name: 2-amino-5-chloro-3-thiocyanato-benzoic acid ethyl ester Formula: C10H9ClN2O2S MolecularWeight: 256.70866

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=CC(=C1N)SC#N)Cl

Isomeric SMILES

CCOC(=O)C1=CC(=CC(=C1N)SC#N)Cl

InChI

InChI=1S/C10H9ClN2O2S/c1-2-15-10(14)7-3-6(11)4-8(9(7)13)16-5-12/h3-4H,2,13H2,1H3