2-ethoxy-3,6-bis(heptylamino)-5-methyl-cyclohexa-2,5-diene-1,4-dione

Systemtic Name: 2-ethoxy-3,6-bis(heptylamino)-5-methyl-cyclohexa-2,5-diene-1,4-dione Openeye Name: 2-ethoxy-3,6-bis(heptylamino)-5-methyl-1,4-benzoquinone CAS Name: 2-ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione IUPAC Name: 2-ethoxy-3,6-bis(heptylamino)-5-methylcyclohexa-2,5-diene-1,4-dione Traditional Name: 2-ethoxy-3,6-bis(heptylamino)-5-methyl-p-benzoquinone Formula: C23H40N2O3 MolecularWeight: 392.5753

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCNC1=C(C(=O)C(=C(C1=O)OCC)NCCCCCCC)C

Isomeric SMILES

CCCCCCCNC1=C(C(=O)C(=C(C1=O)OCC)NCCCCCCC)C

InChI

InChI=1S/C23H40N2O3/c1-5-8-10-12-14-16-24-19-18(4)21(26)20(23(22(19)27)28-7-3)25-17-15-13-11-9-6-2/h24-25H,5-17H2,1-4H3