(2S)-3-methyl-2-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]butanoate

Systemtic Name: (2S)-3-methyl-2-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]butanoate Openeye Name: (2S)-3-methyl-2-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]butanoate CAS Name: (2S)-3-methyl-2-[[(2S,3S)-3-methyl-1-oxo-2-phenylpentyl]amino]butanoate IUPAC Name: (2S)-3-methyl-2-[[(2S,3S)-3-methyl-2-phenylpentanoyl]amino]butanoate Traditional Name: (2S)-3-methyl-2-[[(2S,3S)-3-methyl-2-phenyl-pentanoyl]amino]butyrate Formula: C17H24NO3- MolecularWeight: 290.37736

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C(C1=CC=CC=C1)C(=O)NC(C(C)C)C(=O)[O-]

Isomeric SMILES

CC[C@H](C)[C@@H](C1=CC=CC=C1)C(=O)N[C@@H](C(C)C)C(=O)[O-]

InChI

InChI=1S/C17H25NO3/c1-5-12(4)14(13-9-7-6-8-10-13)16(19)18-15(11(2)3)17(20)21/h6-12,14-15H,5H2,1-4H3,(H,18,19)(H,20,21)/p-1/t12-,14-,15-/m0/s1