[(2S)-octan-2-yl] (2S)-2-acetamido-3-phenyl-propanoate

Systemtic Name: [(2S)-octan-2-yl] (2S)-2-acetamido-3-phenyl-propanoate Openeye Name: [(1S)-1-methylheptyl] (2S)-2-acetamido-3-phenyl-propanoate CAS Name: (2S)-2-acetamido-3-phenylpropanoic acid [(2S)-octan-2-yl] ester IUPAC Name: [(2S)-octan-2-yl] (2S)-2-acetamido-3-phenylpropanoate Traditional Name: (2S)-2-acetamido-3-phenyl-propionic acid [(1S)-1-methylheptyl] ester Formula: C19H29NO3 MolecularWeight: 319.43846

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCC(C)OC(=O)C(CC1=CC=CC=C1)NC(=O)C

Isomeric SMILES

CCCCCC[C@H](C)OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C

InChI

InChI=1S/C19H29NO3/c1-4-5-6-8-11-15(2)23-19(22)18(20-16(3)21)14-17-12-9-7-10-13-17/h7,9-10,12-13,15,18H,4-6,8,11,14H2,1-3H3,(H,20,21)/t15-,18-/m0/s1