(1-cyanoindolizin-2-yl)methyl 1-azanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate

Systemtic Name: (1-cyanoindolizin-2-yl)methyl 1-azanyl-9,10-bis(oxidanylidene)anthracene-2-carboxylate Openeye Name: (1-cyanoindolizin-2-yl)methyl 1-amino-9,10-dioxo-anthracene-2-carboxylate CAS Name: 1-amino-9,10-dioxo-2-anthracenecarboxylic acid (1-cyano-2-indolizinyl)methyl ester IUPAC Name: (1-cyanoindolizin-2-yl)methyl 1-amino-9,10-dioxoanthracene-2-carboxylate Traditional Name: 1-amino-9,10-diketo-anthracene-2-carboxylic acid (1-cyanoindolizin-2-yl)methyl ester Formula: C25H15N3O4 MolecularWeight: 421.4043

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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)OCC4=CN5C=CC=CC5=C4C#N)N

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)C3=C(C2=O)C(=C(C=C3)C(=O)OCC4=CN5C=CC=CC5=C4C#N)N

InChI

InChI=1S/C25H15N3O4/c26-11-19-14(12-28-10-4-3-7-20(19)28)13-32-25(31)18-9-8-17-21(22(18)27)24(30)16-6-2-1-5-15(16)23(17)29/h1-10,12H,13,27H2