nonyl (2S)-2-(2-methylpropoxycarbonylamino)-3-phenyl-propanoate

Systemtic Name: nonyl (2S)-2-(2-methylpropoxycarbonylamino)-3-phenyl-propanoate Openeye Name: nonyl (2S)-2-(isobutoxycarbonylamino)-3-phenyl-propanoate CAS Name: (2S)-2-[[2-methylpropoxy(oxo)methyl]amino]-3-phenylpropanoic acid nonyl ester IUPAC Name: nonyl (2S)-2-(2-methylpropoxycarbonylamino)-3-phenylpropanoate Traditional Name: (2S)-2-(isobutoxycarbonylamino)-3-phenyl-propionic acid nonyl ester Formula: C23H37NO4 MolecularWeight: 391.54418

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCOC(=O)C(CC1=CC=CC=C1)NC(=O)OCC(C)C

Isomeric SMILES

CCCCCCCCCOC(=O)[C@H](CC1=CC=CC=C1)NC(=O)OCC(C)C

InChI

InChI=1S/C23H37NO4/c1-4-5-6-7-8-9-13-16-27-22(25)21(17-20-14-11-10-12-15-20)24-23(26)28-18-19(2)3/h10-12,14-15,19,21H,4-9,13,16-18H2,1-3H3,(H,24,26)/t21-/m0/s1