[2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate

Systemtic Name: [2-[(4-butylphenyl)amino]-2-oxidanylidene-ethyl] (2S)-2-[1,3-bis(oxidanylidene)isoindol-2-yl]propanoate Openeye Name: [2-(4-butylanilino)-2-oxo-ethyl] (2S)-2-(1,3-dioxoisoindolin-2-yl)propanoate CAS Name: (2S)-2-(1,3-dioxo-2-isoindolyl)propanoic acid [2-(4-butylanilino)-2-oxoethyl] ester IUPAC Name: [2-(4-butylanilino)-2-oxoethyl] (2S)-2-(1,3-dioxoisoindol-2-yl)propanoate Traditional Name: (2S)-2-phthalimidopropionic acid [2-(4-butylanilino)-2-keto-ethyl] ester Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)C(C)N2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCCCC1=CC=C(C=C1)NC(=O)COC(=O)[C@H](C)N2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C23H24N2O5/c1-3-4-7-16-10-12-17(13-11-16)24-20(26)14-30-23(29)15(2)25-21(27)18-8-5-6-9-19(18)22(25)28/h5-6,8-13,15H,3-4,7,14H2,1-2H3,(H,24,26)/t15-/m0/s1