1-[4-[1,2-bis(oxidanyl)ethyl]-2,6-diisocyanato-3-methyl-phenyl]butane-1,4-diol

Systemtic Name: 1-[4-[1,2-bis(oxidanyl)ethyl]-2,6-diisocyanato-3-methyl-phenyl]butane-1,4-diol Openeye Name: 1-[4-(1,2-dihydroxyethyl)-2,6-diisocyanato-3-methyl-phenyl]butane-1,4-diol CAS Name: 1-[4-(1,2-dihydroxyethyl)-2,6-diisocyanato-3-methylphenyl]butane-1,4-diol IUPAC Name: 1-[4-(1,2-dihydroxyethyl)-2,6-diisocyanato-3-methylphenyl]butane-1,4-diol Traditional Name: 1-[4-(1,2-dihydroxyethyl)-2,6-diisocyanato-3-methyl-phenyl]butane-1,4-diol Formula: C15H18N2O6 MolecularWeight: 322.31322

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1C(CO)O)N=C=O)C(CCCO)O)N=C=O

Isomeric SMILES

CC1=C(C(=C(C=C1C(CO)O)N=C=O)C(CCCO)O)N=C=O

InChI

InChI=1S/C15H18N2O6/c1-9-10(13(23)6-19)5-11(16-7-20)14(15(9)17-8-21)12(22)3-2-4-18/h5,12-13,18-19,22-23H,2-4,6H2,1H3