4-chloranyl-2-ethyl-1-isocyanato-benzene

Systemtic Name: 4-chloranyl-2-ethyl-1-isocyanato-benzene Openeye Name: 4-chloro-2-ethyl-1-isocyanato-benzene CAS Name: 4-chloro-2-ethyl-1-isocyanatobenzene IUPAC Name: 4-chloro-2-ethyl-1-isocyanatobenzene Traditional Name: 4-chloro-2-ethyl-1-isocyanato-benzene Formula: C9H8ClNO MolecularWeight: 181.61892

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C=CC(=C1)Cl)N=C=O

Isomeric SMILES

CCC1=C(C=CC(=C1)Cl)N=C=O

InChI

InChI=1S/C9H8ClNO/c1-2-7-5-8(10)3-4-9(7)11-6-12/h3-5H,2H2,1H3