3-azanyl-8-piperazin-1-yl-chromen-2-one; 2-oxidanylpropane-1,2,3-tricarboxylic acid

Systemtic Name: 3-azanyl-8-piperazin-1-yl-chromen-2-one; 2-oxidanylpropane-1,2,3-tricarboxylic acid Openeye Name: 3-amino-8-piperazin-1-yl-chromen-2-one; citric acid CAS Name: 3-amino-8-(1-piperazinyl)-1-benzopyran-2-one; 2-hydroxypropane-1,2,3-tricarboxylic acid IUPAC Name: 3-amino-8-piperazin-1-ylchromen-2-one; 2-hydroxypropane-1,2,3-tricarboxylic acid Traditional Name: 3-amino-8-piperazino-coumarin; citric acid Formula: C19H23N3O9 MolecularWeight: 437.40062

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1)C2=CC=CC3=C2OC(=O)C(=C3)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

Isomeric SMILES

C1CN(CCN1)C2=CC=CC3=C2OC(=O)C(=C3)N.C(C(=O)O)C(CC(=O)O)(C(=O)O)O

InChI

InChI=1S/C13H15N3O2.C6H8O7/c14-10-8-9-2-1-3-11(12(9)18-13(10)17)16-6-4-15-5-7-16;7-3(8)1-6(13,5(11)12)2-4(9)10/h1-3,8,15H,4-7,14H2;13H,1-2H2,(H,7,8)(H,9,10)(H,11,12)