N-(1,2-dimethyl-1,2-diazinan-4-yl)-N-phenyl-ethanamide; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: N-(1,2-dimethyl-1,2-diazinan-4-yl)-N-phenyl-ethanamide; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; N-(1,2-dimethylhexahydropyridazin-4-yl)-N-phenyl-acetamide CAS Name: N-(1,2-dimethyl-4-diazinanyl)-N-phenylacetamide; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: N-(1,2-dimethyldiazinan-4-yl)-N-phenylacetamide; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: citric acid; N-(1,2-dimethylhexahydropyridazin-4-yl)-N-phenyl-acetamide Formula: C20H29N3O8 MolecularWeight: 439.45956

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)N(C1CCN(N(C1)C)C)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CC(=O)N(C1CCN(N(C1)C)C)C2=CC=CC=C2.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C14H21N3O.C6H8O7/c1-12(18)17(13-7-5-4-6-8-13)14-9-10-15(2)16(3)11-14;7-3(8)1-6(13,5(11)12)2-4(9)10/h4-8,14H,9-11H2,1-3H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)