2-(3-butan-2-yl-4-ethoxy-phenyl)indolizine-1-carboxylic acid

Systemtic Name: 2-(3-butan-2-yl-4-ethoxy-phenyl)indolizine-1-carboxylic acid Openeye Name: 2-(4-ethoxy-3-sec-butyl-phenyl)indolizine-1-carboxylic acid CAS Name: 2-(3-butan-2-yl-4-ethoxyphenyl)-1-indolizinecarboxylic acid IUPAC Name: 2-(3-butan-2-yl-4-ethoxyphenyl)indolizine-1-carboxylic acid Traditional Name: 2-(4-ethoxy-3-sec-butyl-phenyl)indolizine-1-carboxylic acid Formula: C21H23NO3 MolecularWeight: 337.41222

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Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=C(C=CC(=C1)C2=CN3C=CC=CC3=C2C(=O)O)OCC

Isomeric SMILES

CCC(C)C1=C(C=CC(=C1)C2=CN3C=CC=CC3=C2C(=O)O)OCC

InChI

InChI=1S/C21H23NO3/c1-4-14(3)16-12-15(9-10-19(16)25-5-2)17-13-22-11-7-6-8-18(22)20(17)21(23)24/h6-14H,4-5H2,1-3H3,(H,23,24)