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

Systemtic Name: methyl 3-[[1,3-bis(oxidanylidene)-2-prop-2-enyl-isoindol-5-yl]carbonylamino]-4-methyl-benzoate Openeye Name: methyl 3-[(2-allyl-1,3-dioxo-isoindoline-5-carbonyl)amino]-4-methyl-benzoate CAS Name: 3-[[(1,3-dioxo-2-prop-2-enyl-5-isoindolyl)-oxomethyl]amino]-4-methylbenzoic acid methyl ester IUPAC Name: methyl 3-[(1,3-dioxo-2-prop-2-enylisoindole-5-carbonyl)amino]-4-methylbenzoate Traditional Name: 3-[(2-allyl-1,3-diketo-isoindoline-5-carbonyl)amino]-4-methyl-benzoic acid methyl ester Formula: C21H18N2O5 MolecularWeight: 378.37802

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C21H18N2O5/c1-4-9-23-19(25)15-8-7-13(10-16(15)20(23)26)18(24)22-17-11-14(21(27)28-3)6-5-12(17)2/h4-8,10-11H,1,9H2,2-3H3,(H,22,24)