[1-[2-(octylcarbamothioyl)phenyl]-2,3-bis(oxidanyl)propyl] carbamate

Systemtic Name: [1-[2-(octylcarbamothioyl)phenyl]-2,3-bis(oxidanyl)propyl] carbamate Openeye Name: [2,3-dihydroxy-1-[2-(octylcarbamothioyl)phenyl]propyl] carbamate CAS Name: carbamic acid [2,3-dihydroxy-1-[2-[(octylamino)-sulfanylidenemethyl]phenyl]propyl] ester IUPAC Name: [2,3-dihydroxy-1-[2-(octylcarbamothioyl)phenyl]propyl] carbamate Traditional Name: carbamic acid [2,3-dihydroxy-1-[2-(octylthiocarbamoyl)phenyl]propyl] ester Formula: C19H30N2O4S MolecularWeight: 382.5175

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCNC(=S)C1=CC=CC=C1C(C(CO)O)OC(=O)N

Isomeric SMILES

CCCCCCCCNC(=S)C1=CC=CC=C1C(C(CO)O)OC(=O)N

InChI

InChI=1S/C19H30N2O4S/c1-2-3-4-5-6-9-12-21-18(26)15-11-8-7-10-14(15)17(16(23)13-22)25-19(20)24/h7-8,10-11,16-17,22-23H,2-6,9,12-13H2,1H3,(H2,20,24)(H,21,26)