5-[3,3-dimethyl-2,5-bis(oxidanylidene)hexadecan-6-yl]-3,4-dimethyl-1H-pyrrole-2-carbaldehyde

Systemtic Name: 5-[3,3-dimethyl-2,5-bis(oxidanylidene)hexadecan-6-yl]-3,4-dimethyl-1H-pyrrole-2-carbaldehyde Openeye Name: 5-[1-(3,3-dimethyl-4-oxo-pentanoyl)undecyl]-3,4-dimethyl-1H-pyrrole-2-carbaldehyde CAS Name: 5-(3,3-dimethyl-2,5-dioxohexadecan-6-yl)-3,4-dimethyl-1H-pyrrole-2-carboxaldehyde IUPAC Name: 5-(3,3-dimethyl-2,5-dioxohexadecan-6-yl)-3,4-dimethyl-1H-pyrrole-2-carbaldehyde Traditional Name: 5-[1-(4-keto-3,3-dimethyl-pentanoyl)undecyl]-3,4-dimethyl-1H-pyrrole-2-carbaldehyde Formula: C25H41NO3 MolecularWeight: 403.59794

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC(C1=C(C(=C(N1)C=O)C)C)C(=O)CC(C)(C)C(=O)C

Isomeric SMILES

CCCCCCCCCCC(C1=C(C(=C(N1)C=O)C)C)C(=O)CC(C)(C)C(=O)C

InChI

InChI=1S/C25H41NO3/c1-7-8-9-10-11-12-13-14-15-21(23(29)16-25(5,6)20(4)28)24-19(3)18(2)22(17-27)26-24/h17,21,26H,7-16H2,1-6H3