methyl 4-[[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonyl-methyl-amino]methyl]benzoate

Systemtic Name: methyl 4-[[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonyl-methyl-amino]methyl]benzoate Openeye Name: methyl 4-[[(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)-methyl-amino]methyl]benzoate CAS Name: 4-[[[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]-methylamino]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[[(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)-methylamino]methyl]benzoate Traditional Name: 4-[[(2-allyl-1,3-diketo-isoindoline-5-carbonyl)-methyl-amino]methyl]benzoic acid methyl ester Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

Isomeric SMILES

CN(CC1=CC=C(C=C1)C(=O)OC)C(=O)C2=CC3=C(C=C2)C(=O)N(C3=O)CC=C

InChI

InChI=1S/C22H20N2O5/c1-4-11-24-20(26)17-10-9-16(12-18(17)21(24)27)19(25)23(2)13-14-5-7-15(8-6-14)22(28)29-3/h4-10,12H,1,11,13H2,2-3H3