1-[(1R)-1-isocyanatobut-3-enyl]-4-methyl-benzene

Systemtic Name: 1-[(1R)-1-isocyanatobut-3-enyl]-4-methyl-benzene Openeye Name: 1-[(1R)-1-isocyanatobut-3-enyl]-4-methyl-benzene CAS Name: 1-[(1R)-1-isocyanatobut-3-enyl]-4-methylbenzene IUPAC Name: 1-[(1R)-1-isocyanatobut-3-enyl]-4-methylbenzene Traditional Name: 1-[(1R)-1-isocyanatobut-3-enyl]-4-methyl-benzene Formula: C12H13NO MolecularWeight: 187.23772

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

CC1=CC=C(C=C1)[C@@H](CC=C)N=C=O

InChI

InChI=1S/C12H13NO/c1-3-4-12(13-9-14)11-7-5-10(2)6-8-11/h3,5-8,12H,1,4H2,2H3/t12-/m1/s1