methyl (2S)-2-azanyl-3-(4-azanyl-3-chloranyl-phenyl)propanoate

Systemtic Name: methyl (2S)-2-azanyl-3-(4-azanyl-3-chloranyl-phenyl)propanoate Openeye Name: methyl (2S)-2-amino-3-(4-amino-3-chloro-phenyl)propanoate CAS Name: (2S)-2-amino-3-(4-amino-3-chlorophenyl)propanoic acid methyl ester IUPAC Name: methyl (2S)-2-amino-3-(4-amino-3-chlorophenyl)propanoate Traditional Name: (2S)-2-amino-3-(4-amino-3-chloro-phenyl)propionic acid methyl ester Formula: C10H13ClN2O2 MolecularWeight: 228.67542

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C(CC1=CC(=C(C=C1)N)Cl)N

Isomeric SMILES

COC(=O)[C@H](CC1=CC(=C(C=C1)N)Cl)N

InChI

InChI=1S/C10H13ClN2O2/c1-15-10(14)9(13)5-6-2-3-8(12)7(11)4-6/h2-4,9H,5,12-13H2,1H3/t9-/m0/s1