[1-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-1-oxidanylidene-propan-2-yl] 2-azanyl-5-bromanyl-benzoate

Systemtic Name: [1-[[9,10-bis(oxidanylidene)anthracen-1-yl]amino]-1-oxidanylidene-propan-2-yl] 2-azanyl-5-bromanyl-benzoate Openeye Name: [2-[(9,10-dioxo-1-anthryl)amino]-1-methyl-2-oxo-ethyl] 2-amino-5-bromo-benzoate CAS Name: 2-amino-5-bromobenzoic acid [1-[(9,10-dioxo-1-anthracenyl)amino]-1-oxopropan-2-yl] ester IUPAC Name: [1-[(9,10-dioxoanthracen-1-yl)amino]-1-oxopropan-2-yl] 2-amino-5-bromobenzoate Traditional Name: 2-amino-5-bromo-benzoic acid [2-[(9,10-diketo-1-anthryl)amino]-2-keto-1-methyl-ethyl] ester Formula: C24H17BrN2O5 MolecularWeight: 493.30618

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O)OC(=O)C4=C(C=CC(=C4)Br)N

Isomeric SMILES

CC(C(=O)NC1=CC=CC2=C1C(=O)C3=CC=CC=C3C2=O)OC(=O)C4=C(C=CC(=C4)Br)N

InChI

InChI=1S/C24H17BrN2O5/c1-12(32-24(31)17-11-13(25)9-10-18(17)26)23(30)27-19-8-4-7-16-20(19)22(29)15-6-3-2-5-14(15)21(16)28/h2-12H,26H2,1H3,(H,27,30)