1-(1-ethyl-3,6-dihydro-2H-pyridin-5-yl)-2-methoxy-ethanone; 2-oxidanylpropane-1,2,3-tricarboxylate

Systemtic Name: 1-(1-ethyl-3,6-dihydro-2H-pyridin-5-yl)-2-methoxy-ethanone; 2-oxidanylpropane-1,2,3-tricarboxylate Openeye Name: 1-(1-ethyl-3,6-dihydro-2H-pyridin-5-yl)-2-methoxy-ethanone citrate CAS Name: 1-(1-ethyl-3,6-dihydro-2H-pyridin-5-yl)-2-methoxyethanone; 2-hydroxypropane-1,2,3-tricarboxylate IUPAC Name: 1-(1-ethyl-3,6-dihydro-2H-pyridin-5-yl)-2-methoxyethanone; 2-hydroxypropane-1,2,3-tricarboxylate Traditional Name: 1-(1-ethyl-3,6-dihydro-2H-pyridin-5-yl)-2-methoxy-ethanone citrate Formula: C16H22NO9-3 MolecularWeight: 372.34718

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCC=C(C1)C(=O)COC.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

Isomeric SMILES

CCN1CCC=C(C1)C(=O)COC.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O

InChI

InChI=1S/C10H17NO2.C6H8O7/c1-3-11-6-4-5-9(7-11)10(12)8-13-2;7-3(8)1-6(13,5(11)12)2-4(9)10/h5H,3-4,6-8H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)/p-3