1,3-benzoxazol-2-ylmethyl (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate

Systemtic Name: 1,3-benzoxazol-2-ylmethyl (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate Openeye Name: 1,3-benzoxazol-2-ylmethyl (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[2-(1-naphthalenyl)-1-oxoethyl]amino]butanoic acid 1,3-benzoxazol-2-ylmethyl ester IUPAC Name: 1,3-benzoxazol-2-ylmethyl (2S)-3-methyl-2-[(2-naphthalen-1-ylacetyl)amino]butanoate Traditional Name: (2S)-3-methyl-2-[[2-(1-naphthyl)acetyl]amino]butyric acid 1,3-benzoxazol-2-ylmethyl ester Formula: C25H24N2O4 MolecularWeight: 416.46906

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OCC1=NC2=CC=CC=C2O1)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)[C@@H](C(=O)OCC1=NC2=CC=CC=C2O1)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C25H24N2O4/c1-16(2)24(25(29)30-15-23-26-20-12-5-6-13-21(20)31-23)27-22(28)14-18-10-7-9-17-8-3-4-11-19(17)18/h3-13,16,24H,14-15H2,1-2H3,(H,27,28)/t24-/m0/s1