(3S)-3-[[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-oxidanylidene-butanoic acid

Systemtic Name: (3S)-3-[[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-oxidanylidene-butanoic acid Openeye Name: (3S)-3-[[(2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-oxo-butanoic acid CAS Name: (3S)-3-[[(2S)-4-methyl-1-oxo-2-(phenylmethoxycarbonylamino)pentyl]amino]-4-oxobutanoic acid IUPAC Name: (3S)-3-[[(2S)-4-methyl-2-(phenylmethoxycarbonylamino)pentanoyl]amino]-4-oxobutanoic acid Traditional Name: (3S)-3-[[(2S)-2-(benzyloxycarbonylamino)-4-methyl-pentanoyl]amino]-4-keto-butyric acid Formula: C18H24N2O6 MolecularWeight: 364.39296

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H24N2O6/c1-12(2)8-15(17(24)19-14(10-21)9-16(22)23)20-18(25)26-11-13-6-4-3-5-7-13/h3-7,10,12,14-15H,8-9,11H2,1-2H3,(H,19,24)(H,20,25)(H,22,23)/t14-,15-/m0/s1