diethyl 5-[11-[1,3-bis(oxidanylidene)isoindol-2-yl]undecanoylamino]-3-methyl-thiophene-2,4-dicarboxylate

Systemtic Name: diethyl 5-[11-[1,3-bis(oxidanylidene)isoindol-2-yl]undecanoylamino]-3-methyl-thiophene-2,4-dicarboxylate Openeye Name: diethyl 5-[11-(1,3-dioxoisoindolin-2-yl)undecanoylamino]-3-methyl-thiophene-2,4-dicarboxylate CAS Name: 5-[[11-(1,3-dioxo-2-isoindolyl)-1-oxoundecyl]amino]-3-methylthiophene-2,4-dicarboxylic acid diethyl ester IUPAC Name: diethyl 5-[11-(1,3-dioxoisoindol-2-yl)undecanoylamino]-3-methylthiophene-2,4-dicarboxylate Traditional Name: 3-methyl-5-(11-phthalimidoundecanoylamino)thiophene-2,4-dicarboxylic acid diethyl ester Formula: C30H38N2O7S MolecularWeight: 570.69692

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CCCCCCCCCCN2C(=O)C3=CC=CC=C3C2=O

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1C)C(=O)OCC)NC(=O)CCCCCCCCCCN2C(=O)C3=CC=CC=C3C2=O

InChI

InChI=1S/C30H38N2O7S/c1-4-38-29(36)24-20(3)25(30(37)39-5-2)40-26(24)31-23(33)18-12-10-8-6-7-9-11-15-19-32-27(34)21-16-13-14-17-22(21)28(32)35/h13-14,16-17H,4-12,15,18-19H2,1-3H3,(H,31,33)