(4-chloranylnaphthalen-1-yl) 3-(2,2-dimethylpropanoylamino)propanoate

Systemtic Name: (4-chloranylnaphthalen-1-yl) 3-(2,2-dimethylpropanoylamino)propanoate Openeye Name: (4-chloro-1-naphthyl) 3-(2,2-dimethylpropanoylamino)propanoate CAS Name: 3-[(2,2-dimethyl-1-oxopropyl)amino]propanoic acid (4-chloro-1-naphthalenyl) ester IUPAC Name: (4-chloronaphthalen-1-yl) 3-(2,2-dimethylpropanoylamino)propanoate Traditional Name: 3-(pivaloylamino)propionic acid (4-chloro-1-naphthyl) ester Formula: C18H20ClNO3 MolecularWeight: 333.8093

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)NCCC(=O)OC1=CC=C(C2=CC=CC=C21)Cl

Isomeric SMILES

CC(C)(C)C(=O)NCCC(=O)OC1=CC=C(C2=CC=CC=C21)Cl

InChI

InChI=1S/C18H20ClNO3/c1-18(2,3)17(22)20-11-10-16(21)23-15-9-8-14(19)12-6-4-5-7-13(12)15/h4-9H,10-11H2,1-3H3,(H,20,22)