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

Systemtic Name: 2-isocyanato-4-(isocyanatomethyl)-1-pentyl-benzene Openeye Name: 2-isocyanato-4-(isocyanatomethyl)-1-pentyl-benzene CAS Name: 2-isocyanato-4-(isocyanatomethyl)-1-pentylbenzene IUPAC Name: 2-isocyanato-4-(isocyanatomethyl)-1-pentylbenzene Traditional Name: 1-amyl-2-isocyanato-4-(isocyanatomethyl)benzene Formula: C14H16N2O2 MolecularWeight: 244.28904

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCC1=C(C=C(C=C1)CN=C=O)N=C=O

Isomeric SMILES

CCCCCC1=C(C=C(C=C1)CN=C=O)N=C=O

InChI

InChI=1S/C14H16N2O2/c1-2-3-4-5-13-7-6-12(9-15-10-17)8-14(13)16-11-18/h6-8H,2-5,9H2,1H3