tert-butyl 3-azanyl-2-(ethanoylsulfanylmethyl)benzoate

Systemtic Name: tert-butyl 3-azanyl-2-(ethanoylsulfanylmethyl)benzoate Openeye Name: tert-butyl 2-(acetylsulfanylmethyl)-3-amino-benzoate CAS Name: 2-[(acetylthio)methyl]-3-aminobenzoic acid tert-butyl ester IUPAC Name: tert-butyl 2-(acetylsulfanylmethyl)-3-aminobenzoate Traditional Name: 2-[(acetylthio)methyl]-3-amino-benzoic acid tert-butyl ester Formula: C14H19NO3S MolecularWeight: 281.37056

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)SCC1=C(C=CC=C1N)C(=O)OC(C)(C)C

Isomeric SMILES

CC(=O)SCC1=C(C=CC=C1N)C(=O)OC(C)(C)C

InChI

InChI=1S/C14H19NO3S/c1-9(16)19-8-11-10(6-5-7-12(11)15)13(17)18-14(2,3)4/h5-7H,8,15H2,1-4H3