3-pyridin-4-ylpropyl (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoate

Systemtic Name: 3-pyridin-4-ylpropyl (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]-3-phenyl-propanoate Openeye Name: 3-(4-pyridyl)propyl (2S)-2-(1,3-dioxoisoindolin-2-yl)-3-phenyl-propanoate CAS Name: (2S)-2-(1,3-dioxo-2-isoindolyl)-3-phenylpropanoic acid 3-pyridin-4-ylpropyl ester IUPAC Name: 3-pyridin-4-ylpropyl (2S)-2-(1,3-dioxoisoindol-2-yl)-3-phenylpropanoate Traditional Name: (2S)-3-phenyl-2-phthalimido-propionic acid 3-(4-pyridyl)propyl ester Formula: C25H22N2O4 MolecularWeight: 414.45318

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CC(C(=O)OCCCC2=CC=NC=C2)N3C(=O)C4=CC=CC=C4C3=O

Isomeric SMILES

C1=CC=C(C=C1)C[C@@H](C(=O)OCCCC2=CC=NC=C2)N3C(=O)C4=CC=CC=C4C3=O

InChI

InChI=1S/C25H22N2O4/c28-23-20-10-4-5-11-21(20)24(29)27(23)22(17-19-7-2-1-3-8-19)25(30)31-16-6-9-18-12-14-26-15-13-18/h1-5,7-8,10-15,22H,6,9,16-17H2/t22-/m0/s1