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3-[5-(3,4,5-trimethoxyphenyl)carbonylindol-1-yl]propanoic acid

3-[5-(3,4,5-trimethoxyphenyl)carbonylindol-1-yl]propanoic acid

Systemtic Name:3-[5-(3,4,5-trimethoxyphenyl)carbonylindol-1-yl]propanoic acid
Openeye Name:3-[5-(3,4,5-trimethoxybenzoyl)indol-1-yl]propanoic acid
CAS Name:3-[5-[oxo-(3,4,5-trimethoxyphenyl)methyl]-1-indolyl]propanoic acid
IUPAC Name:3-[5-(3,4,5-trimethoxybenzoyl)indol-1-yl]propanoic acid
Traditional Name:3-[5-(3,4,5-trimethoxybenzoyl)indol-1-yl]propionic acid
Formula: C21H21NO6
MolecularWeight: 383.39454
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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C(=O)C2=CC3=C(C=C2)N(C=C3)CCC(=O)O


Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C(=O)C2=CC3=C(C=C2)N(C=C3)CCC(=O)O


InChI

InChI=1S/C21H21NO6/c1-26-17-11-15(12-18(27-2)21(17)28-3)20(25)14-4-5-16-13(10-14)6-8-22(16)9-7-19(23)24/h4-6,8,10-12H,7,9H2,1-3H3,(H,23,24)


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