benzotriazol-1-yl 2,4-bis[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate

Systemtic Name: benzotriazol-1-yl 2,4-bis[1,3-bis(oxidanylidene)isoindol-2-yl]butanoate Openeye Name: benzotriazol-1-yl 2,4-bis(1,3-dioxoisoindolin-2-yl)butanoate CAS Name: 2,4-bis(1,3-dioxo-2-isoindolyl)butanoic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 2,4-bis(1,3-dioxoisoindol-2-yl)butanoate Traditional Name: 2,4-diphthalimidobutyric acid benzotriazol-1-yl ester Formula: C26H17N5O6 MolecularWeight: 495.44308

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(C(=O)ON3C4=CC=CC=C4N=N3)N5C(=O)C6=CC=CC=C6C5=O

Isomeric SMILES

C1=CC=C2C(=C1)C(=O)N(C2=O)CCC(C(=O)ON3C4=CC=CC=C4N=N3)N5C(=O)C6=CC=CC=C6C5=O

InChI

InChI=1S/C26H17N5O6/c32-22-15-7-1-2-8-16(15)23(33)29(22)14-13-21(30-24(34)17-9-3-4-10-18(17)25(30)35)26(36)37-31-20-12-6-5-11-19(20)27-28-31/h1-12,21H,13-14H2