hexyl 4-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbonylamino]benzoate

Systemtic Name: hexyl 4-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbonylamino]benzoate Openeye Name: hexyl 4-[[4-(1,3-dioxoisoindolin-2-yl)benzoyl]amino]benzoate CAS Name: 4-[[[4-(1,3-dioxo-2-isoindolyl)phenyl]-oxomethyl]amino]benzoic acid hexyl ester IUPAC Name: hexyl 4-[[4-(1,3-dioxoisoindol-2-yl)benzoyl]amino]benzoate Traditional Name: 4-[(4-phthalimidobenzoyl)amino]benzoic acid hexyl ester Formula: C28H26N2O5 MolecularWeight: 470.51644

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCCCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC=C(C=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C28H26N2O5/c1-2-3-4-7-18-35-28(34)20-10-14-21(15-11-20)29-25(31)19-12-16-22(17-13-19)30-26(32)23-8-5-6-9-24(23)27(30)33/h5-6,8-17H,2-4,7,18H2,1H3,(H,29,31)