(2S)-2-[(3-chloranyl-4-cyano-phenyl)-(cyclopropylmethyl)amino]propanoic acid

Systemtic Name: (2S)-2-[(3-chloranyl-4-cyano-phenyl)-(cyclopropylmethyl)amino]propanoic acid Openeye Name: (2S)-2-[3-chloro-4-cyano-N-(cyclopropylmethyl)anilino]propanoic acid CAS Name: (2S)-2-[3-chloro-4-cyano-N-(cyclopropylmethyl)anilino]propanoic acid IUPAC Name: (2S)-2-[3-chloro-4-cyano-N-(cyclopropylmethyl)anilino]propanoic acid Traditional Name: (2S)-2-[3-chloro-4-cyano-N-(cyclopropylmethyl)anilino]propionic acid Formula: C14H15ClN2O2 MolecularWeight: 278.7341

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)O)N(CC1CC1)C2=CC(=C(C=C2)C#N)Cl

Isomeric SMILES

C[C@@H](C(=O)O)N(CC1CC1)C2=CC(=C(C=C2)C#N)Cl

InChI

InChI=1S/C14H15ClN2O2/c1-9(14(18)19)17(8-10-2-3-10)12-5-4-11(7-16)13(15)6-12/h4-6,9-10H,2-3,8H2,1H3,(H,18,19)/t9-/m0/s1