isocyanatobenzene; methane

Systemtic Name: isocyanatobenzene; methane Openeye Name: isocyanatobenzene; methane CAS Name: isocyanatobenzene; methane IUPAC Name: isocyanatobenzene; methane Traditional Name: isocyanatobenzene; methane Formula: C15H14N2O2 MolecularWeight: 254.28386

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2C7H5NO.CH4/c2*9-6-8-7-4-2-1-3-5-7;/h2*1-5H;1H4