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

Systemtic Name: methyl 3-[[2-(3-methoxypropyl)-1,3-bis(oxidanylidene)isoindol-5-yl]carbonylamino]-3-thiophen-2-yl-propanoate Openeye Name: methyl 3-[[2-(3-methoxypropyl)-1,3-dioxo-isoindoline-5-carbonyl]amino]-3-(2-thienyl)propanoate CAS Name: 3-[[[2-(3-methoxypropyl)-1,3-dioxo-5-isoindolyl]-oxomethyl]amino]-3-thiophen-2-ylpropanoic acid methyl ester IUPAC Name: methyl 3-[[2-(3-methoxypropyl)-1,3-dioxoisoindole-5-carbonyl]amino]-3-thiophen-2-ylpropanoate Traditional Name: 3-[[1,3-diketo-2-(3-methoxypropyl)isoindoline-5-carbonyl]amino]-3-(2-thienyl)propionic acid methyl ester Formula: C21H22N2O6S MolecularWeight: 430.47418

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Descriptors Computed from Structure

Canonical SMILES:

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC(CC(=O)OC)C3=CC=CS3

Isomeric SMILES

COCCCN1C(=O)C2=C(C1=O)C=C(C=C2)C(=O)NC(CC(=O)OC)C3=CC=CS3

InChI

InChI=1S/C21H22N2O6S/c1-28-9-4-8-23-20(26)14-7-6-13(11-15(14)21(23)27)19(25)22-16(12-18(24)29-2)17-5-3-10-30-17/h3,5-7,10-11,16H,4,8-9,12H2,1-2H3,(H,22,25)