[[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoyl]amino] 6-oxidanylidenehexanoate

Systemtic Name: [[3-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoyl]amino] 6-oxidanylidenehexanoate Openeye Name: [[3-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propanoyl]amino] 6-oxohexanoate CAS Name: 6-oxohexanoic acid [[3-(1,3-dioxo-2-isoindolyl)-1-oxo-3-phenylpropyl]amino] ester IUPAC Name: [[3-(1,3-dioxoisoindol-2-yl)-3-phenylpropanoyl]amino] 6-oxohexanoate Traditional Name: 6-ketohexanoic acid [(3-phenyl-3-phthalimido-propanoyl)amino] ester Formula: C23H22N2O6 MolecularWeight: 422.43058

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(CC(=O)NOC(=O)CCCCC=O)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

C1=CC=C(C=C1)C(CC(=O)NOC(=O)CCCCC=O)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H22N2O6/c26-14-8-2-5-13-21(28)31-24-20(27)15-19(16-9-3-1-4-10-16)25-22(29)17-11-6-7-12-18(17)23(25)30/h1,3-4,6-7,9-12,14,19H,2,5,8,13,15H2,(H,24,27)