1-[3,6-bis(azanylidene)-2-octadecanoyl-cyclohexa-1,4-dien-1-yl]octadecan-1-one

Systemtic Name: 1-[3,6-bis(azanylidene)-2-octadecanoyl-cyclohexa-1,4-dien-1-yl]octadecan-1-one Openeye Name: 1-(3,6-diimino-2-octadecanoyl-cyclohexa-1,4-dien-1-yl)octadecan-1-one CAS Name: 1-[3,6-diimino-2-(1-oxooctadecyl)-1-cyclohexa-1,4-dienyl]-1-octadecanone IUPAC Name: 1-(3,6-diimino-2-octadecanoylcyclohexa-1,4-dien-1-yl)octadecan-1-one Traditional Name: 1-(3,6-diimino-2-stearoyl-cyclohexa-1,4-dien-1-yl)octadecan-1-one Formula: C42H74N2O2 MolecularWeight: 639.04916

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCCCCCC(=O)C1=C(C(=N)C=CC1=N)C(=O)CCCCCCCCCCCCCCCCC

Isomeric SMILES

CCCCCCCCCCCCCCCCCC(=O)C1=C(C(=N)C=CC1=N)C(=O)CCCCCCCCCCCCCCCCC

InChI

InChI=1S/C42H74N2O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-39(45)41-37(43)35-36-38(44)42(41)40(46)34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h35-36,43-44H,3-34H2,1-2H3