butane-1,3-diol; [diisocyanato(phenyl)methyl]benzene

Systemtic Name: butane-1,3-diol; [diisocyanato(phenyl)methyl]benzene Openeye Name: butane-1,3-diol; [diisocyanato(phenyl)methyl]benzene CAS Name: butane-1,3-diol; [diisocyanato(phenyl)methyl]benzene IUPAC Name: butane-1,3-diol; [diisocyanato(phenyl)methyl]benzene Traditional Name: butane-1,3-diol; [diisocyanato(phenyl)methyl]benzene Formula: C19H20N2O4 MolecularWeight: 340.3731

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Descriptors Computed from Structure

Canonical SMILES:

CC(CCO)O.C1=CC=C(C=C1)C(C2=CC=CC=C2)(N=C=O)N=C=O

Isomeric SMILES

CC(CCO)O.C1=CC=C(C=C1)C(C2=CC=CC=C2)(N=C=O)N=C=O

InChI

InChI=1S/C15H10N2O2.C4H10O2/c18-11-16-15(17-12-19,13-7-3-1-4-8-13)14-9-5-2-6-10-14;1-4(6)2-3-5/h1-10H;4-6H,2-3H2,1H3