3-chloranyl-2-ethyl-5-propyl-benzenecarbonitrile

Systemtic Name: 3-chloranyl-2-ethyl-5-propyl-benzenecarbonitrile Openeye Name: 3-chloro-2-ethyl-5-propyl-benzonitrile CAS Name: 3-chloro-2-ethyl-5-propylbenzonitrile IUPAC Name: 3-chloro-2-ethyl-5-propylbenzonitrile Traditional Name: 3-chloro-2-ethyl-5-propyl-benzonitrile Formula: C12H14ClN MolecularWeight: 207.69926

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C(=C1)C#N)CC)Cl

Isomeric SMILES

CCCC1=CC(=C(C(=C1)C#N)CC)Cl

InChI

InChI=1S/C12H14ClN/c1-3-5-9-6-10(8-14)11(4-2)12(13)7-9/h6-7H,3-5H2,1-2H3