1-chloranyl-2-(3-isocyanato-3-methyl-butyl)benzene

Systemtic Name: 1-chloranyl-2-(3-isocyanato-3-methyl-butyl)benzene Openeye Name: 1-chloro-2-(3-isocyanato-3-methyl-butyl)benzene CAS Name: 1-chloro-2-(3-isocyanato-3-methylbutyl)benzene IUPAC Name: 1-chloro-2-(3-isocyanato-3-methylbutyl)benzene Traditional Name: 1-chloro-2-(3-isocyanato-3-methyl-butyl)benzene Formula: C12H14ClNO MolecularWeight: 223.69866

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(CCC1=CC=CC=C1Cl)N=C=O

Isomeric SMILES

CC(C)(CCC1=CC=CC=C1Cl)N=C=O

InChI

InChI=1S/C12H14ClNO/c1-12(2,14-9-15)8-7-10-5-3-4-6-11(10)13/h3-6H,7-8H2,1-2H3