2-[(1-cyclopentyl-3-ethyl-indazol-6-yl)methylidene]propanedioic acid

Systemtic Name: 2-[(1-cyclopentyl-3-ethyl-indazol-6-yl)methylidene]propanedioic acid Openeye Name: 2-[(1-cyclopentyl-3-ethyl-indazol-6-yl)methylene]propanedioic acid CAS Name: 2-[(1-cyclopentyl-3-ethyl-6-indazolyl)methylidene]propanedioic acid IUPAC Name: 2-[(1-cyclopentyl-3-ethylindazol-6-yl)methylidene]propanedioic acid Traditional Name: 2-[(1-cyclopentyl-3-ethyl-indazol-6-yl)methylene]malonic acid Formula: C18H20N2O4 MolecularWeight: 328.3624

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C=CC(=C2)C=C(C(=O)O)C(=O)O)C3CCCC3

Isomeric SMILES

CCC1=NN(C2=C1C=CC(=C2)C=C(C(=O)O)C(=O)O)C3CCCC3

InChI

InChI=1S/C18H20N2O4/c1-2-15-13-8-7-11(9-14(17(21)22)18(23)24)10-16(13)20(19-15)12-5-3-4-6-12/h7-10,12H,2-6H2,1H3,(H,21,22)(H,23,24)