1-[3-(dimethylamino)propyl]pyrrole-2-carbaldehyde; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 1-[3-(dimethylamino)propyl]pyrrole-2-carbaldehyde; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: citric acid; 1-[3-(dimethylamino)propyl]pyrrole-2-carbaldehyde CAS Name: 1-[3-(dimethylamino)propyl]-2-pyrrolecarboxaldehyde; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 1-[3-(dimethylamino)propyl]pyrrole-2-carbaldehyde; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: citric acid; 1-[3-(dimethylamino)propyl]pyrrole-2-carbaldehyde Formula: C16H24N2O8 MolecularWeight: 372.37036

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCCN1C=CC=C1C=O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

CN(C)CCCN1C=CC=C1C=O.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C10H16N2O.C6H8O7/c1-11(2)6-4-8-12-7-3-5-10(12)9-13;7-3(8)1-6(13,5(11)12)2-4(9)10/h3,5,7,9H,4,6,8H2,1-2H3;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)