1,2-bis(isocyanatomethyl)-3,4,5-trimethyl-benzene

Systemtic Name: 1,2-bis(isocyanatomethyl)-3,4,5-trimethyl-benzene Openeye Name: 1,2-bis(isocyanatomethyl)-3,4,5-trimethyl-benzene CAS Name: 1,2-bis(isocyanatomethyl)-3,4,5-trimethylbenzene IUPAC Name: 1,2-bis(isocyanatomethyl)-3,4,5-trimethylbenzene Traditional Name: 1,2-bis(isocyanatomethyl)-3,4,5-trimethyl-benzene Formula: C13H14N2O2 MolecularWeight: 230.26246

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1C)C)CN=C=O)CN=C=O

Isomeric SMILES

CC1=CC(=C(C(=C1C)C)CN=C=O)CN=C=O

InChI

InChI=1S/C13H14N2O2/c1-9-4-12(5-14-7-16)13(6-15-8-17)11(3)10(9)2/h4H,5-6H2,1-3H3