[4-[6-(oxan-2-yloxy)hexoxy]phenyl] 1-azanyl-4-nitro-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: [4-[6-(oxan-2-yloxy)hexoxy]phenyl] 1-azanyl-4-nitro-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: [4-(6-tetrahydropyran-2-yloxyhexoxy)phenyl] 1-amino-4-nitro-9,10-dioxo-anthracene-2-carboxylate CAS Name: 1-amino-4-nitro-9,10-dioxo-2-anthracenecarboxylic acid [4-[6-(2-oxanyloxy)hexoxy]phenyl] ester IUPAC Name: [4-[6-(oxan-2-yloxy)hexoxy]phenyl] 1-amino-4-nitro-9,10-dioxoanthracene-2-carboxylate Traditional Name: 1-amino-9,10-diketo-4-nitro-anthracene-2-carboxylic acid [4-(6-tetrahydropyran-2-yloxyhexoxy)phenyl] ester Formula: C32H32N2O9 MolecularWeight: 588.60448

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Descriptors Computed from Structure

Canonical SMILES:

C1CCOC(C1)OCCCCCCOC2=CC=C(C=C2)OC(=O)C3=CC(=C4C(=C3N)C(=O)C5=CC=CC=C5C4=O)[N+](=O)[O-]

Isomeric SMILES

C1CCOC(C1)OCCCCCCOC2=CC=C(C=C2)OC(=O)C3=CC(=C4C(=C3N)C(=O)C5=CC=CC=C5C4=O)[N+](=O)[O-]

InChI

InChI=1S/C32H32N2O9/c33-29-24(19-25(34(38)39)27-28(29)31(36)23-10-4-3-9-22(23)30(27)35)32(37)43-21-14-12-20(13-15-21)40-16-6-1-2-7-17-41-26-11-5-8-18-42-26/h3-4,9-10,12-15,19,26H,1-2,5-8,11,16-18,33H2