2-(2-diethylaminoethyl)-4-methoxy-benzenecarbothioic S-acid

Systemtic Name: 2-(2-diethylaminoethyl)-4-methoxy-benzenecarbothioic S-acid Openeye Name: 2-(2-diethylaminoethyl)-4-methoxy-benzenecarbothioic S-acid CAS Name: 2-(2-diethylaminoethyl)-4-methoxybenzenecarbothioic S-acid IUPAC Name: 2-(2-diethylaminoethyl)-4-methoxybenzenecarbothioic S-acid Traditional Name: 2-(2-diethylaminoethyl)-4-methoxy-thiobenzoic acid Formula: C14H21NO2S MolecularWeight: 267.38704

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCC1=C(C=CC(=C1)OC)C(=O)S

Isomeric SMILES

CCN(CC)CCC1=C(C=CC(=C1)OC)C(=O)S

InChI

InChI=1S/C14H21NO2S/c1-4-15(5-2)9-8-11-10-12(17-3)6-7-13(11)14(16)18/h6-7,10H,4-5,8-9H2,1-3H3,(H,16,18)