[(E)-3-isocyanato-2-methyl-pent-2-enyl]benzene

Systemtic Name: [(E)-3-isocyanato-2-methyl-pent-2-enyl]benzene Openeye Name: [(E)-3-isocyanato-2-methyl-pent-2-enyl]benzene CAS Name: [(E)-3-isocyanato-2-methylpent-2-enyl]benzene IUPAC Name: [(E)-3-isocyanato-2-methylpent-2-enyl]benzene Traditional Name: [(E)-3-isocyanato-2-methyl-pent-2-enyl]benzene Formula: C13H15NO MolecularWeight: 201.2643

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15NO/c1-3-13(14-10-15)11(2)9-12-7-5-4-6-8-12/h4-8H,3,9H2,1-2H3/b13-11+