4-isocyanato-1-(isocyanatomethyl)-2-propyl-benzene

Systemtic Name: 4-isocyanato-1-(isocyanatomethyl)-2-propyl-benzene Openeye Name: 4-isocyanato-1-(isocyanatomethyl)-2-propyl-benzene CAS Name: 4-isocyanato-1-(isocyanatomethyl)-2-propylbenzene IUPAC Name: 4-isocyanato-1-(isocyanatomethyl)-2-propylbenzene Traditional Name: 4-isocyanato-1-(isocyanatomethyl)-2-propyl-benzene Formula: C12H12N2O2 MolecularWeight: 216.23588

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1=C(C=CC(=C1)N=C=O)CN=C=O

Isomeric SMILES

CCCC1=C(C=CC(=C1)N=C=O)CN=C=O

InChI

InChI=1S/C12H12N2O2/c1-2-3-10-6-12(14-9-16)5-4-11(10)7-13-8-15/h4-6H,2-3,7H2,1H3