[2-[[9,10-bis(oxidanylidene)anthracen-2-yl]amino]-2-oxidanylidene-ethyl] 2-chloranylcyclohexene-1-carboxylate

Systemtic Name: [2-[[9,10-bis(oxidanylidene)anthracen-2-yl]amino]-2-oxidanylidene-ethyl] 2-chloranylcyclohexene-1-carboxylate Openeye Name: [2-[(9,10-dioxo-2-anthryl)amino]-2-oxo-ethyl] 2-chlorocyclohexene-1-carboxylate CAS Name: 2-chloro-1-cyclohexenecarboxylic acid [2-[(9,10-dioxo-2-anthracenyl)amino]-2-oxoethyl] ester IUPAC Name: [2-[(9,10-dioxoanthracen-2-yl)amino]-2-oxoethyl] 2-chlorocyclohexene-1-carboxylate Traditional Name: 2-chlorocyclohexene-1-carboxylic acid [2-[(9,10-diketo-2-anthryl)amino]-2-keto-ethyl] ester Formula: C23H18ClNO5 MolecularWeight: 423.84572

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(=C(C1)C(=O)OCC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)Cl

Isomeric SMILES

C1CCC(=C(C1)C(=O)OCC(=O)NC2=CC3=C(C=C2)C(=O)C4=CC=CC=C4C3=O)Cl

InChI

InChI=1S/C23H18ClNO5/c24-19-8-4-3-7-17(19)23(29)30-12-20(26)25-13-9-10-16-18(11-13)22(28)15-6-2-1-5-14(15)21(16)27/h1-2,5-6,9-11H,3-4,7-8,12H2,(H,25,26)