1,3-diethyl-2-isocyanato-5-[[4-isocyanato-3,5-bis(2-methylpropyl)phenyl]methyl]benzene

Systemtic Name: 1,3-diethyl-2-isocyanato-5-[[4-isocyanato-3,5-bis(2-methylpropyl)phenyl]methyl]benzene Openeye Name: 5-[(3,5-diethyl-4-isocyanato-phenyl)methyl]-1,3-diisobutyl-2-isocyanato-benzene CAS Name: 1,3-diethyl-2-isocyanato-5-[[4-isocyanato-3,5-bis(2-methylpropyl)phenyl]methyl]benzene IUPAC Name: 1,3-diethyl-2-isocyanato-5-[[4-isocyanato-3,5-bis(2-methylpropyl)phenyl]methyl]benzene Traditional Name: 5-(3,5-diethyl-4-isocyanato-benzyl)-1,3-diisobutyl-2-isocyanato-benzene Formula: C27H34N2O2 MolecularWeight: 418.57106

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=CC(=CC(=C1N=C=O)CC)CC2=CC(=C(C(=C2)CC(C)C)N=C=O)CC(C)C

Isomeric SMILES

CCC1=CC(=CC(=C1N=C=O)CC)CC2=CC(=C(C(=C2)CC(C)C)N=C=O)CC(C)C

InChI

InChI=1S/C27H34N2O2/c1-7-22-12-20(13-23(8-2)26(22)28-16-30)11-21-14-24(9-18(3)4)27(29-17-31)25(15-21)10-19(5)6/h12-15,18-19H,7-11H2,1-6H3