(2R)-2-[[(2S)-2-azaniumyl-3-phenyl-propanoyl]amino]-3-chloranyl-propanoate

Systemtic Name: (2R)-2-[[(2S)-2-azaniumyl-3-phenyl-propanoyl]amino]-3-chloranyl-propanoate Openeye Name: (2R)-2-[[(2S)-2-azaniumyl-3-phenyl-propanoyl]amino]-3-chloro-propanoate CAS Name: (2R)-2-[[(2S)-2-ammonio-1-oxo-3-phenylpropyl]amino]-3-chloropropanoate IUPAC Name: (2R)-2-[[(2S)-2-azaniumyl-3-phenylpropanoyl]amino]-3-chloropropanoate Traditional Name: (2R)-2-[[(2S)-2-ammonio-3-phenyl-propanoyl]amino]-3-chloro-propionate Formula: C12H15ClN2O3 MolecularWeight: 270.7121

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)NC(CCl)C(=O)[O-])[NH3+]

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CCl)C(=O)[O-])[NH3+]

InChI

InChI=1S/C12H15ClN2O3/c13-7-10(12(17)18)15-11(16)9(14)6-8-4-2-1-3-5-8/h1-5,9-10H,6-7,14H2,(H,15,16)(H,17,18)/t9-,10-/m0/s1