6-(2-hydroxyethyloxy)-6-oxidanylidene-hexanoic acid; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene

Systemtic Name: 6-(2-hydroxyethyloxy)-6-oxidanylidene-hexanoic acid; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Openeye Name: 6-(2-hydroxyethoxy)-6-oxo-hexanoic acid; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene CAS Name: 6-(2-hydroxyethoxy)-6-oxohexanoic acid; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene IUPAC Name: 6-(2-hydroxyethoxy)-6-oxohexanoic acid; 1-isocyanato-4-[(4-isocyanatophenyl)methyl]benzene Traditional Name: 6-(2-hydroxyethoxy)-6-keto-hexanoic acid; 1-isocyanato-4-(4-isocyanatobenzyl)benzene Formula: C23H24N2O7 MolecularWeight: 440.44586

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCC(=O)OCCO)CC(=O)O

Isomeric SMILES

C1=CC(=CC=C1CC2=CC=C(C=C2)N=C=O)N=C=O.C(CCC(=O)OCCO)CC(=O)O

InChI

InChI=1S/C15H10N2O2.C8H14O5/c18-10-16-14-5-1-12(2-6-14)9-13-3-7-15(8-4-13)17-11-19;9-5-6-13-8(12)4-2-1-3-7(10)11/h1-8H,9H2;9H,1-6H2,(H,10,11)