(3E,7E)-3,7-bis[(1-butyl-3-oxidanylidene-piperidin-2-yl)imino]-2,6-dihydroanthracene-9,10-dione

Systemtic Name: (3E,7E)-3,7-bis[(1-butyl-3-oxidanylidene-piperidin-2-yl)imino]-2,6-dihydroanthracene-9,10-dione Openeye Name: (3E,7E)-3,7-bis[(1-butyl-3-oxo-2-piperidyl)imino]-2,6-dihydroanthracene-9,10-dione CAS Name: (3E,7E)-3,7-bis[(1-butyl-3-oxo-2-piperidinyl)imino]-2,6-dihydroanthracene-9,10-dione IUPAC Name: (3E,7E)-3,7-bis[(1-butyl-3-oxopiperidin-2-yl)imino]-2,6-dihydroanthracene-9,10-dione Traditional Name: (3E,7E)-3,7-bis[(1-butyl-3-keto-2-piperidyl)imino]-2,6-dihydroanthracene-9,10-quinone Formula: C32H40N4O4 MolecularWeight: 544.6844

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCN1CCCC(=O)C1N=C2CC=C3C(=C2)C(=O)C4=CCC(=NC5C(=O)CCCN5CCCC)C=C4C3=O

Isomeric SMILES

CCCCN1C(C(=O)CCC1)/N=C\2/C=C3C(=O)C4=CC/C(=N\C5N(CCCC5=O)CCCC)/C=C4C(=O)C3=CC2

InChI

InChI=1S/C32H40N4O4/c1-3-5-15-35-17-7-9-27(37)31(35)33-21-11-13-23-25(19-21)29(39)24-14-12-22(20-26(24)30(23)40)34-32-28(38)10-8-18-36(32)16-6-4-2/h13-14,19-20,31-32H,3-12,15-18H2,1-2H3/b33-21+,34-22+