[1-[(3-chloranyl-4-cyano-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(9-oxidanylideneacridin-10-yl)ethanoate

Systemtic Name: [1-[(3-chloranyl-4-cyano-phenyl)amino]-1-oxidanylidene-propan-2-yl] 2-(9-oxidanylideneacridin-10-yl)ethanoate Openeye Name: [2-(3-chloro-4-cyano-anilino)-1-methyl-2-oxo-ethyl] 2-(9-oxoacridin-10-yl)acetate CAS Name: 2-(9-oxo-10-acridinyl)acetic acid [1-(3-chloro-4-cyanoanilino)-1-oxopropan-2-yl] ester IUPAC Name: [1-(3-chloro-4-cyanoanilino)-1-oxopropan-2-yl] 2-(9-oxoacridin-10-yl)acetate Traditional Name: 2-(9-ketoacridin-10-yl)acetic acid [2-(3-chloro-4-cyano-anilino)-2-keto-1-methyl-ethyl] ester Formula: C25H18ClN3O4 MolecularWeight: 459.88112

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC(=C(C=C1)C#N)Cl)OC(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42

Isomeric SMILES

CC(C(=O)NC1=CC(=C(C=C1)C#N)Cl)OC(=O)CN2C3=CC=CC=C3C(=O)C4=CC=CC=C42

InChI

InChI=1S/C25H18ClN3O4/c1-15(25(32)28-17-11-10-16(13-27)20(26)12-17)33-23(30)14-29-21-8-4-2-6-18(21)24(31)19-7-3-5-9-22(19)29/h2-12,15H,14H2,1H3,(H,28,32)