(1S,3R,7R,8R,8aR)-8-acetamido-7-ethoxy-1-[(Z)-prop-1-enyl]-7-propyl-2,3,5,6,8,8a-hexahydro-1H-indolizine-3-carboxylic acid; 2,2,2-tris(fluoranyl)ethanoic acid

Systemtic Name: (1S,3R,7R,8R,8aR)-8-acetamido-7-ethoxy-1-[(Z)-prop-1-enyl]-7-propyl-2,3,5,6,8,8a-hexahydro-1H-indolizine-3-carboxylic acid; 2,2,2-tris(fluoranyl)ethanoic acid Openeye Name: (1S,3R,7R,8R,8aR)-8-acetamido-7-ethoxy-1-[(Z)-prop-1-enyl]-7-propyl-2,3,5,6,8,8a-hexahydro-1H-indolizine-3-carboxylic acid; 2,2,2-trifluoroacetic acid CAS Name: (1S,3R,7R,8R,8aR)-8-acetamido-7-ethoxy-1-[(Z)-prop-1-enyl]-7-propyl-2,3,5,6,8,8a-hexahydro-1H-indolizine-3-carboxylic acid; 2,2,2-trifluoroacetic acid IUPAC Name: (1S,3R,7R,8R,8aR)-8-acetamido-7-ethoxy-1-[(Z)-prop-1-enyl]-7-propyl-2,3,5,6,8,8a-hexahydro-1H-indolizine-3-carboxylic acid; 2,2,2-trifluoroacetic acid Traditional Name: (1S,3R,7R,8R,8aR)-8-acetamido-7-ethoxy-1-[(Z)-prop-1-enyl]-7-propyl-indolizidine-3-carboxylic acid; 2,2,2-trifluoroacetic acid Formula: C21H33F3N2O6 MolecularWeight: 466.49173

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Descriptors Computed from Structure

Canonical SMILES:

CCCC1(CCN2C(CC(C2C1NC(=O)C)C=CC)C(=O)O)OCC.C(=O)(C(F)(F)F)O

Isomeric SMILES

CCC[C@]1(CCN2[C@H](C[C@H]([C@@H]2[C@H]1NC(=O)C)/C=C\C)C(=O)O)OCC.C(=O)(C(F)(F)F)O

InChI

InChI=1S/C19H32N2O4.C2HF3O2/c1-5-8-14-12-15(18(23)24)21-11-10-19(9-6-2,25-7-3)17(16(14)21)20-13(4)22;3-2(4,5)1(6)7/h5,8,14-17H,6-7,9-12H2,1-4H3,(H,20,22)(H,23,24);(H,6,7)/b8-5-;/t14-,15-,16-,17-,19-;/m1./s1