1-azanyl-4-nitro-9,10-bis(oxidanylidene)-4-[2-(6-prop-2-enoyloxyhexoxy)phenyl]-1H-anthracene-2-carboxylic acid

Systemtic Name: 1-azanyl-4-nitro-9,10-bis(oxidanylidene)-4-[2-(6-prop-2-enoyloxyhexoxy)phenyl]-1H-anthracene-2-carboxylic acid Openeye Name: 1-amino-4-nitro-9,10-dioxo-4-[2-(6-prop-2-enoyloxyhexoxy)phenyl]-1H-anthracene-2-carboxylic acid CAS Name: 1-amino-4-nitro-9,10-dioxo-4-[2-[6-(1-oxoprop-2-enoxy)hexoxy]phenyl]-1H-anthracene-2-carboxylic acid IUPAC Name: 1-amino-4-nitro-9,10-dioxo-4-[2-(6-prop-2-enoyloxyhexoxy)phenyl]-1H-anthracene-2-carboxylic acid Traditional Name: 4-[2-(6-acryloyloxyhexoxy)phenyl]-1-amino-9,10-diketo-4-nitro-1H-anthracene-2-carboxylic acid Formula: C30H28N2O9 MolecularWeight: 560.55132

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C=CC(=O)OCCCCCCOC1=CC=CC=C1C2(C=C(C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)C(=O)O)[N+](=O)[O-]

Isomeric SMILES

C=CC(=O)OCCCCCCOC1=CC=CC=C1C2(C=C(C(C3=C2C(=O)C4=CC=CC=C4C3=O)N)C(=O)O)[N+](=O)[O-]

InChI

InChI=1S/C30H28N2O9/c1-2-23(33)41-16-10-4-3-9-15-40-22-14-8-7-13-21(22)30(32(38)39)17-20(29(36)37)26(31)24-25(30)28(35)19-12-6-5-11-18(19)27(24)34/h2,5-8,11-14,17,26H,1,3-4,9-10,15-16,31H2,(H,36,37)