tert-butyl N-[3-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-2-oxidanyl-propyl]carbamate

Systemtic Name: tert-butyl N-[3-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-2-oxidanyl-propyl]carbamate Openeye Name: tert-butyl N-[3-[(9,10-dioxo-1-anthryl)amino]-2-hydroxy-propyl]carbamate CAS Name: N-[3-[(9,10-dioxo-1-anthracenyl)amino]-2-hydroxypropyl]carbamic acid tert-butyl ester IUPAC Name: tert-butyl N-[3-[(9,10-dioxoanthracen-1-yl)amino]-2-hydroxypropyl]carbamate Traditional Name: N-[3-[(9,10-diketo-1-anthryl)amino]-2-hydroxy-propyl]carbamic acid tert-butyl ester Formula: C22H24N2O5 MolecularWeight: 396.43636

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)NCC(CNC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O)O

Isomeric SMILES

CC(C)(C)OC(=O)NCC(CNC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O)O

InChI

InChI=1S/C22H24N2O5/c1-22(2,3)29-21(28)24-12-13(25)11-23-17-10-6-9-16-18(17)20(27)15-8-5-4-7-14(15)19(16)26/h4-10,13,23,25H,11-12H2,1-3H3,(H,24,28)