methyl 4-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]-4-(heptylamino)butanoate

Systemtic Name: methyl 4-[4,4-dimethyl-2,6-bis(oxidanylidene)cyclohexylidene]-4-(heptylamino)butanoate Openeye Name: methyl 4-(4,4-dimethyl-2,6-dioxo-cyclohexylidene)-4-(heptylamino)butanoate CAS Name: 4-(4,4-dimethyl-2,6-dioxocyclohexylidene)-4-(heptylamino)butanoic acid methyl ester IUPAC Name: methyl 4-(4,4-dimethyl-2,6-dioxocyclohexylidene)-4-(heptylamino)butanoate Traditional Name: 4-(2,6-diketo-4,4-dimethyl-cyclohexylidene)-4-(heptylamino)butyric acid methyl ester Formula: C20H33NO4 MolecularWeight: 351.48032

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC(=C1C(=O)CC(CC1=O)(C)C)CCC(=O)OC

Isomeric SMILES

CCCCCCCNC(=C1C(=O)CC(CC1=O)(C)C)CCC(=O)OC

InChI

InChI=1S/C20H33NO4/c1-5-6-7-8-9-12-21-15(10-11-18(24)25-4)19-16(22)13-20(2,3)14-17(19)23/h21H,5-14H2,1-4H3