methyl 5-[(E)-C-heptadecyl-N-prop-2-enoxy-carbonimidoyl]-2,2-dimethyl-4,6-bis(oxidanylidene)cyclohexane-1-carboxylate

Systemtic Name: methyl 5-[(E)-C-heptadecyl-N-prop-2-enoxy-carbonimidoyl]-2,2-dimethyl-4,6-bis(oxidanylidene)cyclohexane-1-carboxylate Openeye Name: methyl 5-[(E)-N-allyloxy-C-heptadecyl-carbonimidoyl]-2,2-dimethyl-4,6-dioxo-cyclohexanecarboxylate CAS Name: 2,2-dimethyl-4,6-dioxo-5-[(1E)-1-prop-2-enoxyiminooctadecyl]-1-cyclohexanecarboxylic acid methyl ester IUPAC Name: methyl 5-[(E)-C-heptadecyl-N-prop-2-enoxycarbonimidoyl]-2,2-dimethyl-4,6-dioxocyclohexane-1-carboxylate Traditional Name: 5-[(E)-N-allyloxy-C-heptadecyl-carbonimidoyl]-4,6-diketo-2,2-dimethyl-cyclohexanecarboxylic acid methyl ester Formula: C31H53NO5 MolecularWeight: 519.75622

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=NOCC=C)C1C(=O)CC(C(C1=O)C(=O)OC)(C)C

Isomeric SMILES

CCCCCCCCCCCCCCCCC/C(=N\OCC=C)/C1C(=O)CC(C(C1=O)C(=O)OC)(C)C

InChI

InChI=1S/C31H53NO5/c1-6-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-25(32-37-23-7-2)27-26(33)24-31(3,4)28(29(27)34)30(35)36-5/h7,27-28H,2,6,8-24H2,1,3-5H3/b32-25+