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

Systemtic Name: methyl 3-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]propanoate Openeye Name: methyl 3-[(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)amino]propanoate CAS Name: 3-[[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 3-[(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)amino]propanoate Traditional Name: 3-[(2-allyl-1,3-diketo-isoindoline-5-carbonyl)amino]propionic acid methyl ester Formula: C16H16N2O5 MolecularWeight: 316.30864

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)CCNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC=C

Isomeric SMILES

COC(=O)CCNC(=O)C1=CC2=C(C=C1)C(=O)N(C2=O)CC=C

InChI

InChI=1S/C16H16N2O5/c1-3-8-18-15(21)11-5-4-10(9-12(11)16(18)22)14(20)17-7-6-13(19)23-2/h3-5,9H,1,6-8H2,2H3,(H,17,20)