(3-chloranyl-1-benzothiophen-2-yl)methyl 3-(2,2-dimethylpropanoylamino)propanoate

Systemtic Name: (3-chloranyl-1-benzothiophen-2-yl)methyl 3-(2,2-dimethylpropanoylamino)propanoate Openeye Name: (3-chlorobenzothiophen-2-yl)methyl 3-(2,2-dimethylpropanoylamino)propanoate CAS Name: 3-[(2,2-dimethyl-1-oxopropyl)amino]propanoic acid (3-chloro-1-benzothiophen-2-yl)methyl ester IUPAC Name: (3-chloro-1-benzothiophen-2-yl)methyl 3-(2,2-dimethylpropanoylamino)propanoate Traditional Name: 3-(pivaloylamino)propionic acid (3-chlorobenzothiophen-2-yl)methyl ester Formula: C17H20ClNO3S MolecularWeight: 353.8636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NCCC(=O)OCC1=C(C2=CC=CC=C2S1)Cl

Isomeric SMILES

CC(C)(C)C(=O)NCCC(=O)OCC1=C(C2=CC=CC=C2S1)Cl

InChI

InChI=1S/C17H20ClNO3S/c1-17(2,3)16(21)19-9-8-14(20)22-10-13-15(18)11-6-4-5-7-12(11)23-13/h4-7H,8-10H2,1-3H3,(H,19,21)