1,6-diisocyanato-5,6-dimethyl-heptane; ethyl 3-oxidanylidenebutanoate

Systemtic Name: 1,6-diisocyanato-5,6-dimethyl-heptane; ethyl 3-oxidanylidenebutanoate Openeye Name: 1,6-diisocyanato-5,6-dimethyl-heptane; ethyl 3-oxobutanoate CAS Name: 1,6-diisocyanato-5,6-dimethylheptane; 3-oxobutanoic acid ethyl ester IUPAC Name: 1,6-diisocyanato-5,6-dimethylheptane; ethyl 3-oxobutanoate Traditional Name: 1,6-diisocyanato-5,6-dimethyl-heptane; 3-ketobutyric acid ethyl ester Formula: C17H28N2O5 MolecularWeight: 340.41462

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)CC(=O)C.CC(CCCCN=C=O)C(C)(C)N=C=O

Isomeric SMILES

CCOC(=O)CC(=O)C.CC(CCCCN=C=O)C(C)(C)N=C=O

InChI

InChI=1S/C11H18N2O2.C6H10O3/c1-10(11(2,3)13-9-15)6-4-5-7-12-8-14;1-3-9-6(8)4-5(2)7/h10H,4-7H2,1-3H3;3-4H2,1-2H3