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3-[2,5-bis(ethoxycarbonyl)-1H-indol-3-yl]propanoic acid

3-[2,5-bis(ethoxycarbonyl)-1H-indol-3-yl]propanoic acid

Systemtic Name:3-[2,5-bis(ethoxycarbonyl)-1H-indol-3-yl]propanoic acid
Openeye Name:3-[2,5-bis(ethoxycarbonyl)-1H-indol-3-yl]propanoic acid
CAS Name:3-[2,5-bis(ethoxycarbonyl)-1H-indol-3-yl]propanoic acid
IUPAC Name:3-[2,5-bis(ethoxycarbonyl)-1H-indol-3-yl]propanoic acid
Traditional Name:3-(2,5-dicarbethoxy-1H-indol-3-yl)propionic acid
Formula: C17H19NO6
MolecularWeight: 333.33586
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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC2=C(C=C1)NC(=C2CCC(=O)O)C(=O)OCC


Isomeric SMILES

CCOC(=O)C1=CC2=C(C=C1)NC(=C2CCC(=O)O)C(=O)OCC


InChI

InChI=1S/C17H19NO6/c1-3-23-16(21)10-5-7-13-12(9-10)11(6-8-14(19)20)15(18-13)17(22)24-4-2/h5,7,9,18H,3-4,6,8H2,1-2H3,(H,19,20)


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