ethyl 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl]indazole-5-carboxylate

Systemtic Name: ethyl 2-[4-[1,3-bis(oxidanylidene)isoindol-2-yl]butyl]indazole-5-carboxylate Openeye Name: ethyl 2-[4-(1,3-dioxoisoindolin-2-yl)butyl]indazole-5-carboxylate CAS Name: 2-[4-(1,3-dioxo-2-isoindolyl)butyl]-5-indazolecarboxylic acid ethyl ester IUPAC Name: ethyl 2-[4-(1,3-dioxoisoindol-2-yl)butyl]indazole-5-carboxylate Traditional Name: 2-(4-phthalimidobutyl)indazole-5-carboxylic acid ethyl ester Formula: C22H21N3O4 MolecularWeight: 391.41984

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=CN(N=C2C=C1)CCCCN3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCOC(=O)C1=CC2=CN(N=C2C=C1)CCCCN3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C22H21N3O4/c1-2-29-22(28)15-9-10-19-16(13-15)14-24(23-19)11-5-6-12-25-20(26)17-7-3-4-8-18(17)21(25)27/h3-4,7-10,13-14H,2,5-6,11-12H2,1H3