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

Systemtic Name: butyl 3-[[2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoyl]amino]benzoate Openeye Name: butyl 3-[[2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propanoyl]amino]benzoate CAS Name: 3-[[2-(1,3-dioxo-2-isoindolyl)-1-oxo-3-phenylpropyl]amino]benzoic acid butyl ester IUPAC Name: butyl 3-[[2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanoyl]amino]benzoate Traditional Name: 3-[(3-phenyl-2-phthalimido-propanoyl)amino]benzoic acid butyl ester Formula: C28H26N2O5 MolecularWeight: 470.51644

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

CCCCOC(=O)C1=CC(=CC=C1)NC(=O)C(CC2=CC=CC=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C28H26N2O5/c1-2-3-16-35-28(34)20-12-9-13-21(18-20)29-25(31)24(17-19-10-5-4-6-11-19)30-26(32)22-14-7-8-15-23(22)27(30)33/h4-15,18,24H,2-3,16-17H2,1H3,(H,29,31)