(3S)-3-azanyl-3-(3-chloranyl-4-methoxy-phenyl)propanoic acid

Systemtic Name: (3S)-3-azanyl-3-(3-chloranyl-4-methoxy-phenyl)propanoic acid Openeye Name: (3S)-3-amino-3-(3-chloro-4-methoxy-phenyl)propanoic acid CAS Name: (3S)-3-amino-3-(3-chloro-4-methoxyphenyl)propanoic acid IUPAC Name: (3S)-3-amino-3-(3-chloro-4-methoxyphenyl)propanoic acid Traditional Name: (3S)-3-amino-3-(3-chloro-4-methoxy-phenyl)propionic acid Formula: C10H12ClNO3 MolecularWeight: 229.66018

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(CC(=O)O)N)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)[C@H](CC(=O)O)N)Cl

InChI

InChI=1S/C10H12ClNO3/c1-15-9-3-2-6(4-7(9)11)8(12)5-10(13)14/h2-4,8H,5,12H2,1H3,(H,13,14)/t8-/m0/s1