tert-butyl 4-[2-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate

Systemtic Name: tert-butyl 4-[2-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-2-oxidanylidene-ethyl]piperazine-1-carboxylate Openeye Name: tert-butyl 4-[2-[(9,10-dioxo-1-anthryl)amino]-2-oxo-ethyl]piperazine-1-carboxylate CAS Name: 4-[2-[(9,10-dioxo-1-anthracenyl)amino]-2-oxoethyl]-1-piperazinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[2-[(9,10-dioxoanthracen-1-yl)amino]-2-oxoethyl]piperazine-1-carboxylate Traditional Name: 4-[2-[(9,10-diketo-1-anthryl)amino]-2-keto-ethyl]piperazine-1-carboxylic acid tert-butyl ester Formula: C25H27N3O5 MolecularWeight: 449.49898

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CC(C)(C)OC(=O)N1CCN(CC1)CC(=O)NC2=CC=CC3=C2C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H27N3O5/c1-25(2,3)33-24(32)28-13-11-27(12-14-28)15-20(29)26-19-10-6-9-18-21(19)23(31)17-8-5-4-7-16(17)22(18)30/h4-10H,11-15H2,1-3H3,(H,26,29)