phenyl 3-[carbonochloridoyl(propyl)amino]sulfanyl-2-methyl-propanoate

Systemtic Name: phenyl 3-[carbonochloridoyl(propyl)amino]sulfanyl-2-methyl-propanoate Openeye Name: phenyl 3-[chlorocarbonyl(propyl)amino]sulfanyl-2-methyl-propanoate CAS Name: 3-[[carbonochloridoyl(propyl)amino]thio]-2-methylpropanoic acid phenyl ester IUPAC Name: phenyl 3-[carbonochloridoyl(propyl)amino]sulfanyl-2-methylpropanoate Traditional Name: 3-[[chlorocarbonyl(propyl)amino]thio]-2-methyl-propionic acid phenyl ester Formula: C14H18ClNO3S MolecularWeight: 315.81562

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Descriptors Computed from Structure

Canonical SMILES:

CCCN(C(=O)Cl)SCC(C)C(=O)OC1=CC=CC=C1

Isomeric SMILES

CCCN(C(=O)Cl)SCC(C)C(=O)OC1=CC=CC=C1

InChI

InChI=1S/C14H18ClNO3S/c1-3-9-16(14(15)18)20-10-11(2)13(17)19-12-7-5-4-6-8-12/h4-8,11H,3,9-10H2,1-2H3