[(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(9-oxidanylideneacridin-10-yl)ethanoate

Systemtic Name: [(E)-4-azanyl-3-cyano-2-oxidanylidene-pent-3-enyl] 2-(9-oxidanylideneacridin-10-yl)ethanoate Openeye Name: [(E)-4-amino-3-cyano-2-oxo-pent-3-enyl] 2-(9-oxoacridin-10-yl)acetate CAS Name: 2-(9-oxo-10-acridinyl)acetic acid [(E)-4-amino-3-cyano-2-oxopent-3-enyl] ester IUPAC Name: [(E)-4-amino-3-cyano-2-oxopent-3-enyl] 2-(9-oxoacridin-10-yl)acetate Traditional Name: 2-(9-ketoacridin-10-yl)acetic acid [(E)-4-amino-3-cyano-2-keto-pent-3-enyl] ester Formula: C21H17N3O4 MolecularWeight: 375.37738

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Descriptors Computed from Structure

Canonical SMILES:

CC(=C(C#N)C(=O)COC(=O)CN1C2=CC=CC=C2C(=O)C3=CC=CC=C31)N

Isomeric SMILES

C/C(=C(/C#N)\C(=O)COC(=O)CN1C2=CC=CC=C2C(=O)C3=CC=CC=C31)/N

InChI

InChI=1S/C21H17N3O4/c1-13(23)16(10-22)19(25)12-28-20(26)11-24-17-8-4-2-6-14(17)21(27)15-7-3-5-9-18(15)24/h2-9H,11-12,23H2,1H3/b16-13+