1-(cyclohexa-1,3-dien-1-ylmethyl)-4-isocyanato-benzene

Systemtic Name: 1-(cyclohexa-1,3-dien-1-ylmethyl)-4-isocyanato-benzene Openeye Name: 1-(cyclohexa-1,3-dien-1-ylmethyl)-4-isocyanato-benzene CAS Name: 1-(1-cyclohexa-1,3-dienylmethyl)-4-isocyanatobenzene IUPAC Name: 1-(cyclohexa-1,3-dien-1-ylmethyl)-4-isocyanatobenzene Traditional Name: 1-(cyclohexa-1,3-dien-1-ylmethyl)-4-isocyanato-benzene Formula: C14H13NO MolecularWeight: 211.25912

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Descriptors Computed from Structure

Canonical SMILES:

C1CC(=CC=C1)CC2=CC=C(C=C2)N=C=O

Isomeric SMILES

C1CC(=CC=C1)CC2=CC=C(C=C2)N=C=O

InChI

InChI=1S/C14H13NO/c16-11-15-14-8-6-13(7-9-14)10-12-4-2-1-3-5-12/h1-2,4,6-9H,3,5,10H2