heptyl (2S)-3-methyl-2-(propoxycarbonylamino)butanoate

Systemtic Name: heptyl (2S)-3-methyl-2-(propoxycarbonylamino)butanoate Openeye Name: heptyl (2S)-3-methyl-2-(propoxycarbonylamino)butanoate CAS Name: (2S)-3-methyl-2-[[oxo(propoxy)methyl]amino]butanoic acid heptyl ester IUPAC Name: heptyl (2S)-3-methyl-2-(propoxycarbonylamino)butanoate Traditional Name: (2S)-3-methyl-2-(propoxycarbonylamino)butyric acid heptyl ester Formula: C16H31NO4 MolecularWeight: 301.42164

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCOC(=O)C(C(C)C)NC(=O)OCCC

Isomeric SMILES

CCCCCCCOC(=O)[C@H](C(C)C)NC(=O)OCCC

InChI

InChI=1S/C16H31NO4/c1-5-7-8-9-10-12-20-15(18)14(13(3)4)17-16(19)21-11-6-2/h13-14H,5-12H2,1-4H3,(H,17,19)/t14-/m0/s1