diethyl 2-[[5-[bis(2-hydroxyethyl)amino]-1H-indol-3-yl]methyl]propanedioate

Systemtic Name: diethyl 2-[[5-[bis(2-hydroxyethyl)amino]-1H-indol-3-yl]methyl]propanedioate Openeye Name: diethyl 2-[[5-[bis(2-hydroxyethyl)amino]-1H-indol-3-yl]methyl]propanedioate CAS Name: 2-[[5-[bis(2-hydroxyethyl)amino]-1H-indol-3-yl]methyl]propanedioic acid diethyl ester IUPAC Name: diethyl 2-[[5-[bis(2-hydroxyethyl)amino]-1H-indol-3-yl]methyl]propanedioate Traditional Name: 2-[[5-[bis(2-hydroxyethyl)amino]-1H-indol-3-yl]methyl]malonic acid diethyl ester Formula: C20H28N2O6 MolecularWeight: 392.44612

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C(CC1=CNC2=C1C=C(C=C2)N(CCO)CCO)C(=O)OCC

Isomeric SMILES

CCOC(=O)C(CC1=CNC2=C1C=C(C=C2)N(CCO)CCO)C(=O)OCC

InChI

InChI=1S/C20H28N2O6/c1-3-27-19(25)17(20(26)28-4-2)11-14-13-21-18-6-5-15(12-16(14)18)22(7-9-23)8-10-24/h5-6,12-13,17,21,23-24H,3-4,7-11H2,1-2H3