1,3-benzodioxol-5-yl (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate

Systemtic Name: 1,3-benzodioxol-5-yl (2S)-3-methyl-2-(2-naphthalen-1-ylethanoylamino)butanoate Openeye Name: 1,3-benzodioxol-5-yl (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-benzodioxol-5-yl ester IUPAC Name: 1,3-benzodioxol-5-yl (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-benzodioxol-5-yl ester Formula: C24H23NO5 MolecularWeight: 405.44312

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC1=CC2=C(C=C1)OCO2)NC(=O)CC3=CC=CC4=CC=CC=C43

Isomeric SMILES

CC(C)[C@@H](C(=O)OC1=CC2=C(C=C1)OCO2)NC(=O)CC3=CC=CC4=CC=CC=C43

InChI

InChI=1S/C24H23NO5/c1-15(2)23(24(27)30-18-10-11-20-21(13-18)29-14-28-20)25-22(26)12-17-8-5-7-16-6-3-4-9-19(16)17/h3-11,13,15,23H,12,14H2,1-2H3,(H,25,26)/t23-/m0/s1