2-phenylpropyl 1,2,3-benzothiadiazole-7-carboxylate

Systemtic Name: 2-phenylpropyl 1,2,3-benzothiadiazole-7-carboxylate Openeye Name: 2-phenylpropyl 1,2,3-benzothiadiazole-7-carboxylate CAS Name: 1,2,3-benzothiadiazole-7-carboxylic acid 2-phenylpropyl ester IUPAC Name: 2-phenylpropyl 1,2,3-benzothiadiazole-7-carboxylate Traditional Name: 1,2,3-benzothiadiazole-7-carboxylic acid 2-phenylpropyl ester Formula: C16H14N2O2S MolecularWeight: 298.35956

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C1=C2C(=CC=C1)N=NS2)C3=CC=CC=C3

Isomeric SMILES

CC(COC(=O)C1=C2C(=CC=C1)N=NS2)C3=CC=CC=C3

InChI

InChI=1S/C16H14N2O2S/c1-11(12-6-3-2-4-7-12)10-20-16(19)13-8-5-9-14-15(13)21-18-17-14/h2-9,11H,10H2,1H3