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

Systemtic Name: pentyl 4-[[4-[1,3-bis(oxidanylidene)isoindol-2-yl]phenyl]carbonylamino]benzoate Openeye Name: pentyl 4-[[4-(1,3-dioxoisoindolin-2-yl)benzoyl]amino]benzoate CAS Name: 4-[[[4-(1,3-dioxo-2-isoindolyl)phenyl]-oxomethyl]amino]benzoic acid pentyl ester IUPAC Name: pentyl 4-[[4-(1,3-dioxoisoindol-2-yl)benzoyl]amino]benzoate Traditional Name: 4-[(4-phthalimidobenzoyl)amino]benzoic acid amyl ester Formula: C27H24N2O5 MolecularWeight: 456.48986

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C27H24N2O5/c1-2-3-6-17-34-27(33)19-9-13-20(14-10-19)28-24(30)18-11-15-21(16-12-18)29-25(31)22-7-4-5-8-23(22)26(29)32/h4-5,7-16H,2-3,6,17H2,1H3,(H,28,30)