4-[2-(azocan-1-yl)-2-oxidanylidene-ethoxy]-3-chloranyl-benzenecarbonitrile

Systemtic Name: 4-[2-(azocan-1-yl)-2-oxidanylidene-ethoxy]-3-chloranyl-benzenecarbonitrile Openeye Name: 4-[2-(azocan-1-yl)-2-oxo-ethoxy]-3-chloro-benzonitrile CAS Name: 4-[2-(1-azocanyl)-2-oxoethoxy]-3-chlorobenzonitrile IUPAC Name: 4-[2-(azocan-1-yl)-2-oxoethoxy]-3-chlorobenzonitrile Traditional Name: 4-[2-(azocan-1-yl)-2-keto-ethoxy]-3-chloro-benzonitrile Formula: C16H19ClN2O2 MolecularWeight: 306.78726

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Descriptors Computed from Structure

Canonical SMILES:

C1CCCN(CCC1)C(=O)COC2=C(C=C(C=C2)C#N)Cl

Isomeric SMILES

C1CCCN(CCC1)C(=O)COC2=C(C=C(C=C2)C#N)Cl

InChI

InChI=1S/C16H19ClN2O2/c17-14-10-13(11-18)6-7-15(14)21-12-16(20)19-8-4-2-1-3-5-9-19/h6-7,10H,1-5,8-9,12H2