2-(9-isocyanato-7,8-dimethoxy-nonan-4-yl)-5-methyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-(9-isocyanato-7,8-dimethoxy-nonan-4-yl)-5-methyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-(6-isocyanato-4,5-dimethoxy-1-propyl-hexyl)-5-methyl-1,4-benzoquinone CAS Name: 2-(9-isocyanato-7,8-dimethoxynonan-4-yl)-5-methylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-(9-isocyanato-7,8-dimethoxynonan-4-yl)-5-methylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-(6-isocyanato-4,5-dimethoxy-1-propyl-hexyl)-5-methyl-p-benzoquinone Formula: C19H27NO5 MolecularWeight: 349.42138

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Descriptors Computed from Structure

Canonical SMILES:

CCCC(CCC(C(CN=C=O)OC)OC)C1=CC(=O)C(=CC1=O)C

Isomeric SMILES

CCCC(CCC(C(CN=C=O)OC)OC)C1=CC(=O)C(=CC1=O)C

InChI

InChI=1S/C19H27NO5/c1-5-6-14(15-10-16(22)13(2)9-17(15)23)7-8-18(24-3)19(25-4)11-20-12-21/h9-10,14,18-19H,5-8,11H2,1-4H3