ethyl 2-azanyl-1-[1,3-bis(oxidanylidene)isoindol-5-yl]pyrrolo[3,2-b]quinoxaline-3-carboxylate

Systemtic Name: ethyl 2-azanyl-1-[1,3-bis(oxidanylidene)isoindol-5-yl]pyrrolo[3,2-b]quinoxaline-3-carboxylate Openeye Name: ethyl 2-amino-1-(1,3-dioxoisoindolin-5-yl)pyrrolo[3,2-b]quinoxaline-3-carboxylate CAS Name: 2-amino-1-(1,3-dioxo-5-isoindolyl)-3-pyrrolo[3,2-b]quinoxalinecarboxylic acid ethyl ester IUPAC Name: ethyl 2-amino-1-(1,3-dioxoisoindol-5-yl)pyrrolo[3,2-b]quinoxaline-3-carboxylate Traditional Name: 2-amino-1-(1,3-diketoisoindolin-5-yl)pyrrolo[3,2-b]quinoxaline-3-carboxylic acid ethyl ester Formula: C21H15N5O4 MolecularWeight: 401.3749

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC5=C(C=C4)C(=O)NC5=O)N

Isomeric SMILES

CCOC(=O)C1=C(N(C2=NC3=CC=CC=C3N=C12)C4=CC5=C(C=C4)C(=O)NC5=O)N

InChI

InChI=1S/C21H15N5O4/c1-2-30-21(29)15-16-18(24-14-6-4-3-5-13(14)23-16)26(17(15)22)10-7-8-11-12(9-10)20(28)25-19(11)27/h3-9H,2,22H2,1H3,(H,25,27,28)