2-chloranyl-3-dodecyl-4-oxidanyl-benzenecarbonitrile

Systemtic Name: 2-chloranyl-3-dodecyl-4-oxidanyl-benzenecarbonitrile Openeye Name: 2-chloro-3-dodecyl-4-hydroxy-benzonitrile CAS Name: 2-chloro-3-dodecyl-4-hydroxybenzonitrile IUPAC Name: 2-chloro-3-dodecyl-4-hydroxybenzonitrile Traditional Name: 2-chloro-4-hydroxy-3-lauryl-benzonitrile Formula: C19H28ClNO MolecularWeight: 321.88472

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCC1=C(C=CC(=C1Cl)C#N)O

Isomeric SMILES

CCCCCCCCCCCCC1=C(C=CC(=C1Cl)C#N)O

InChI

InChI=1S/C19H28ClNO/c1-2-3-4-5-6-7-8-9-10-11-12-17-18(22)14-13-16(15-21)19(17)20/h13-14,22H,2-12H2,1H3