1-(isocyanatomethyl)-2,3,4,5,6-pentamethyl-benzene

Systemtic Name: 1-(isocyanatomethyl)-2,3,4,5,6-pentamethyl-benzene Openeye Name: 1-(isocyanatomethyl)-2,3,4,5,6-pentamethyl-benzene CAS Name: 1-(isocyanatomethyl)-2,3,4,5,6-pentamethylbenzene IUPAC Name: 1-(isocyanatomethyl)-2,3,4,5,6-pentamethylbenzene Traditional Name: 1-(isocyanatomethyl)-2,3,4,5,6-pentamethyl-benzene Formula: C13H17NO MolecularWeight: 203.28018

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H17NO/c1-8-9(2)11(4)13(6-14-7-15)12(5)10(8)3/h6H2,1-5H3