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

Systemtic Name: 2-[(3-chloranyl-4-cyano-phenyl)-(cyclopropylmethyl)amino]butanoic acid Openeye Name: 2-[3-chloro-4-cyano-N-(cyclopropylmethyl)anilino]butanoic acid CAS Name: 2-[3-chloro-4-cyano-N-(cyclopropylmethyl)anilino]butanoic acid IUPAC Name: 2-[3-chloro-4-cyano-N-(cyclopropylmethyl)anilino]butanoic acid Traditional Name: 2-[3-chloro-4-cyano-N-(cyclopropylmethyl)anilino]butyric acid Formula: C15H17ClN2O2 MolecularWeight: 292.76068

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C15H17ClN2O2/c1-2-14(15(19)20)18(9-10-3-4-10)12-6-5-11(8-17)13(16)7-12/h5-7,10,14H,2-4,9H2,1H3,(H,19,20)