(2S)-4-methyl-2-[[(2S)-2-[(2-oxidanidyl-2-oxidanylidene-ethyl)azaniumyl]-3-phenyl-propanoyl]amino]pentanoate

Systemtic Name: (2S)-4-methyl-2-[[(2S)-2-[(2-oxidanidyl-2-oxidanylidene-ethyl)azaniumyl]-3-phenyl-propanoyl]amino]pentanoate Openeye Name: (2S)-4-methyl-2-[[(2S)-2-[(2-oxido-2-oxo-ethyl)ammonio]-3-phenyl-propanoyl]amino]pentanoate CAS Name: (2S)-4-methyl-2-[[(2S)-2-[(2-oxido-2-oxoethyl)ammonio]-1-oxo-3-phenylpropyl]amino]pentanoate IUPAC Name: (2S)-4-methyl-2-[[(2S)-2-[(2-oxido-2-oxoethyl)azaniumyl]-3-phenylpropanoyl]amino]pentanoate Traditional Name: (2S)-2-[[(2S)-2-[(2-keto-2-oxido-ethyl)ammonio]-3-phenyl-propanoyl]amino]-4-methyl-valerate Formula: C17H23N2O5- MolecularWeight: 335.37492

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)C(CC1=CC=CC=C1)[NH2+]CC(=O)[O-]

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)[C@H](CC1=CC=CC=C1)[NH2+]CC(=O)[O-]

InChI

InChI=1S/C17H24N2O5/c1-11(2)8-14(17(23)24)19-16(22)13(18-10-15(20)21)9-12-6-4-3-5-7-12/h3-7,11,13-14,18H,8-10H2,1-2H3,(H,19,22)(H,20,21)(H,23,24)/p-1/t13-,14-/m0/s1