5-isocyanato-1,5-dimethyl-cyclohexa-1,3-diene

Systemtic Name: 5-isocyanato-1,5-dimethyl-cyclohexa-1,3-diene Openeye Name: 5-isocyanato-1,5-dimethyl-cyclohexa-1,3-diene CAS Name: 5-isocyanato-1,5-dimethylcyclohexa-1,3-diene IUPAC Name: 5-isocyanato-1,5-dimethylcyclohexa-1,3-diene Traditional Name: 5-isocyanato-1,5-dimethyl-cyclohexa-1,3-diene Formula: C9H11NO MolecularWeight: 149.18974

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(C1)(C)N=C=O

Isomeric SMILES

CC1=CC=CC(C1)(C)N=C=O

InChI

InChI=1S/C9H11NO/c1-8-4-3-5-9(2,6-8)10-7-11/h3-5H,6H2,1-2H3