[2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 1-chloranyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: [2-[(3-cyanophenyl)amino]-2-oxidanylidene-ethyl] 1-chloranyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: [2-(3-cyanoanilino)-2-oxo-ethyl] 1-chloro-9,10-dioxo-anthracene-2-carboxylate CAS Name: 1-chloro-9,10-dioxo-2-anthracenecarboxylic acid [2-(3-cyanoanilino)-2-oxoethyl] ester IUPAC Name: [2-(3-cyanoanilino)-2-oxoethyl] 1-chloro-9,10-dioxoanthracene-2-carboxylate Traditional Name: 1-chloro-9,10-diketo-anthracene-2-carboxylic acid [2-(3-cyanoanilino)-2-keto-ethyl] ester Formula: C24H13ClN2O5 MolecularWeight: 444.82342

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)OCC(=O)NC4=CC=CC(=C4)C#N)Cl

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)OCC(=O)NC4=CC=CC(=C4)C#N)Cl

InChI

InChI=1S/C24H13ClN2O5/c25-21-18(24(31)32-12-19(28)27-14-5-3-4-13(10-14)11-26)9-8-17-20(21)23(30)16-7-2-1-6-15(16)22(17)29/h1-10H,12H2,(H,27,28)