methyl (2S)-2-[[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylamino]-3-methyl-butanoate

Systemtic Name: methyl (2S)-2-[[1,3-bis(oxidanylidene)-2-phenethyl-isoindol-5-yl]carbonylamino]-3-methyl-butanoate Openeye Name: methyl (2S)-2-[(1,3-dioxo-2-phenethyl-isoindoline-5-carbonyl)amino]-3-methyl-butanoate CAS Name: (2S)-2-[[(1,3-dioxo-2-phenethyl-5-isoindolyl)-oxomethyl]amino]-3-methylbutanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1,3-dioxo-2-phenethylisoindole-5-carbonyl)amino]-3-methylbutanoate Traditional Name: (2S)-2-[(1,3-diketo-2-phenethyl-isoindoline-5-carbonyl)amino]-3-methyl-butyric acid methyl ester Formula: C23H24N2O5 MolecularWeight: 408.44706

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)OC)NC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CCC3=CC=CC=C3

Isomeric SMILES

CC(C)[C@@H](C(=O)OC)NC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CCC3=CC=CC=C3

InChI

InChI=1S/C23H24N2O5/c1-14(2)19(23(29)30-3)24-20(26)16-9-10-17-18(13-16)22(28)25(21(17)27)12-11-15-7-5-4-6-8-15/h4-10,13-14,19H,11-12H2,1-3H3,(H,24,26)/t19-/m0/s1