3-(heptoxymethyl)benzenecarbothioamide

Systemtic Name: 3-(heptoxymethyl)benzenecarbothioamide Openeye Name: 3-(heptoxymethyl)benzenecarbothioamide CAS Name: 3-(heptoxymethyl)benzenecarbothioamide IUPAC Name: 3-(heptoxymethyl)benzenecarbothioamide Traditional Name: 3-(heptoxymethyl)thiobenzamide Formula: C15H23NOS MolecularWeight: 265.41422

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOCC1=CC=CC(=C1)C(=S)N

Isomeric SMILES

CCCCCCCOCC1=CC=CC(=C1)C(=S)N

InChI

InChI=1S/C15H23NOS/c1-2-3-4-5-6-10-17-12-13-8-7-9-14(11-13)15(16)18/h7-9,11H,2-6,10,12H2,1H3,(H2,16,18)