6-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbonylamino]hexanoic acid

Systemtic Name: 6-[[9,10-bis(oxidanylidene)anthracen-2-yl]carbonylamino]hexanoic acid Openeye Name: 6-[(9,10-dioxoanthracene-2-carbonyl)amino]hexanoic acid CAS Name: 6-[[(9,10-dioxo-2-anthracenyl)-oxomethyl]amino]hexanoic acid IUPAC Name: 6-[(9,10-dioxoanthracene-2-carbonyl)amino]hexanoic acid Traditional Name: 6-[(9,10-diketoanthracene-2-carbonyl)amino]hexanoic acid Formula: C21H19NO5 MolecularWeight: 365.37926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCCCC(=O)O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C=C(C=C3)C(=O)NCCCCCC(=O)O

InChI

InChI=1S/C21H19NO5/c23-18(24)8-2-1-5-11-22-21(27)13-9-10-16-17(12-13)20(26)15-7-4-3-6-14(15)19(16)25/h3-4,6-7,9-10,12H,1-2,5,8,11H2,(H,22,27)(H,23,24)