2-[[(2S)-3-methyl-2-[2-(phenylmethoxycarbonylamino)ethanoylamino]butanoyl]amino]ethanoic acid

Systemtic Name: 2-[[(2S)-3-methyl-2-[2-(phenylmethoxycarbonylamino)ethanoylamino]butanoyl]amino]ethanoic acid Openeye Name: 2-[[(2S)-2-[[2-(benzyloxycarbonylamino)acetyl]amino]-3-methyl-butanoyl]amino]acetic acid CAS Name: 2-[[(2S)-3-methyl-1-oxo-2-[[1-oxo-2-(phenylmethoxycarbonylamino)ethyl]amino]butyl]amino]acetic acid IUPAC Name: 2-[[(2S)-3-methyl-2-[[2-(phenylmethoxycarbonylamino)acetyl]amino]butanoyl]amino]acetic acid Traditional Name: 2-[[(2S)-2-[[2-(benzyloxycarbonylamino)acetyl]amino]-3-methyl-butanoyl]amino]acetic acid Formula: C17H23N3O6 MolecularWeight: 365.38102

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC(=O)O)NC(=O)CNC(=O)OCC1=CC=CC=C1

Isomeric SMILES

CC(C)[C@@H](C(=O)NCC(=O)O)NC(=O)CNC(=O)OCC1=CC=CC=C1

InChI

InChI=1S/C17H23N3O6/c1-11(2)15(16(24)18-9-14(22)23)20-13(21)8-19-17(25)26-10-12-6-4-3-5-7-12/h3-7,11,15H,8-10H2,1-2H3,(H,18,24)(H,19,25)(H,20,21)(H,22,23)/t15-/m0/s1