ethyl 4-azanyl-3-thiocyanato-benzoate

Systemtic Name: ethyl 4-azanyl-3-thiocyanato-benzoate Openeye Name: ethyl 4-amino-3-thiocyanato-benzoate CAS Name: 4-amino-3-thiocyanatobenzoic acid ethyl ester IUPAC Name: ethyl 4-amino-3-thiocyanatobenzoate Traditional Name: 4-amino-3-thiocyanato-benzoic acid ethyl ester Formula: C10H10N2O2S MolecularWeight: 222.2636

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)N)SC#N

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)N)SC#N

InChI

InChI=1S/C10H10N2O2S/c1-2-14-10(13)7-3-4-8(12)9(5-7)15-6-11/h3-5H,2,12H2,1H3