methyl (2S)-2-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]-4-methyl-pentanoate

Systemtic Name: methyl (2S)-2-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]-4-methyl-pentanoate Openeye Name: methyl (2S)-2-[(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl (2S)-2-[(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)amino]-4-methylpentanoate Traditional Name: (2S)-2-[(2-allyl-1,3-diketo-isoindoline-5-carbonyl)amino]-4-methyl-valeric acid methyl ester Formula: C19H22N2O5 MolecularWeight: 358.38838

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C19H22N2O5/c1-5-8-21-17(23)13-7-6-12(10-14(13)18(21)24)16(22)20-15(9-11(2)3)19(25)26-4/h5-7,10-11,15H,1,8-9H2,2-4H3,(H,20,22)/t15-/m0/s1