tert-butyl 2-[4-(2-azanylethyl)phenyl]sulfanylpropanoate

Systemtic Name: tert-butyl 2-[4-(2-azanylethyl)phenyl]sulfanylpropanoate Openeye Name: tert-butyl 2-[4-(2-aminoethyl)phenyl]sulfanylpropanoate CAS Name: 2-[[4-(2-aminoethyl)phenyl]thio]propanoic acid tert-butyl ester IUPAC Name: tert-butyl 2-[4-(2-aminoethyl)phenyl]sulfanylpropanoate Traditional Name: 2-[[4-(2-aminoethyl)phenyl]thio]propionic acid tert-butyl ester Formula: C15H23NO2S MolecularWeight: 281.41362

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC(C)(C)C)SC1=CC=C(C=C1)CCN

Isomeric SMILES

CC(C(=O)OC(C)(C)C)SC1=CC=C(C=C1)CCN

InChI

InChI=1S/C15H23NO2S/c1-11(14(17)18-15(2,3)4)19-13-7-5-12(6-8-13)9-10-16/h5-8,11H,9-10,16H2,1-4H3