N-(1-ethylpiperidin-4-yl)-N-phenyl-propanamide; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: N-(1-ethylpiperidin-4-yl)-N-phenyl-propanamide; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; N-(1-ethyl-4-piperidyl)-N-phenyl-propanamide CAS Name: N-(1-ethyl-4-piperidinyl)-N-phenylpropanamide; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: N-(1-ethylpiperidin-4-yl)-N-phenylpropanamide; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: citric acid; N-(1-ethyl-4-piperidyl)-N-phenyl-propionamide Formula: C22H32N2O8 MolecularWeight: 452.49808

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)N(C1CCN(CC1)CC)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CCC(=O)N(C1CCN(CC1)CC)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C16H24N2O.C6H8O7/c1-3-16(19)18(14-8-6-5-7-9-14)15-10-12-17(4-2)13-11-15;7-3(8)1-6(13,5(11)12)2-4(9)10/h5-9,15H,3-4,10-13H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)