3-(octoxymethyl)benzenecarbothioamide

Systemtic Name: 3-(octoxymethyl)benzenecarbothioamide Openeye Name: 3-(octoxymethyl)benzenecarbothioamide CAS Name: 3-(octoxymethyl)benzenecarbothioamide IUPAC Name: 3-(octoxymethyl)benzenecarbothioamide Traditional Name: 3-(octoxymethyl)thiobenzamide Formula: C16H25NOS MolecularWeight: 279.4408

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCOCC1=CC=CC(=C1)C(=S)N

Isomeric SMILES

CCCCCCCCOCC1=CC=CC(=C1)C(=S)N

InChI

InChI=1S/C16H25NOS/c1-2-3-4-5-6-7-11-18-13-14-9-8-10-15(12-14)16(17)19/h8-10,12H,2-7,11,13H2,1H3,(H2,17,19)