3-(3-chloranyl-4-cycloheptyl-phenyl)-3-cyano-propanoic acid

Systemtic Name: 3-(3-chloranyl-4-cycloheptyl-phenyl)-3-cyano-propanoic acid Openeye Name: 3-(3-chloro-4-cycloheptyl-phenyl)-3-cyano-propanoic acid CAS Name: 3-(3-chloro-4-cycloheptylphenyl)-3-cyanopropanoic acid IUPAC Name: 3-(3-chloro-4-cycloheptylphenyl)-3-cyanopropanoic acid Traditional Name: 3-(3-chloro-4-cycloheptyl-phenyl)-3-cyano-propionic acid Formula: C17H20ClNO2 MolecularWeight: 305.7992

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCC(CC1)C2=C(C=C(C=C2)C(CC(=O)O)C#N)Cl

Isomeric SMILES

C1CCCC(CC1)C2=C(C=C(C=C2)C(CC(=O)O)C#N)Cl

InChI

InChI=1S/C17H20ClNO2/c18-16-9-13(14(11-19)10-17(20)21)7-8-15(16)12-5-3-1-2-4-6-12/h7-9,12,14H,1-6,10H2,(H,20,21)