O-(2-dimethylaminoethyl) 4-ethoxybenzenecarbothioate

Systemtic Name: O-(2-dimethylaminoethyl) 4-ethoxybenzenecarbothioate Openeye Name: O-(2-dimethylaminoethyl) 4-ethoxybenzenecarbothioate CAS Name: 4-ethoxybenzenecarbothioic acid O-(2-dimethylaminoethyl) ester IUPAC Name: O-(2-dimethylaminoethyl) 4-ethoxybenzenecarbothioate Traditional Name: 4-ethoxythiobenzoic acid O-(2-dimethylaminoethyl) ester Formula: C13H19NO2S MolecularWeight: 253.36046

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)C(=S)OCCN(C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)C(=S)OCCN(C)C

InChI

InChI=1S/C13H19NO2S/c1-4-15-12-7-5-11(6-8-12)13(17)16-10-9-14(2)3/h5-8H,4,9-10H2,1-3H3