1-[(2S)-2-azanylpropyl]-2H-indazol-6-one; (E)-but-2-enedioic acid

Systemtic Name: 1-[(2S)-2-azanylpropyl]-2H-indazol-6-one; (E)-but-2-enedioic acid Openeye Name: 1-[(2S)-2-aminopropyl]-2H-indazol-6-one; fumaric acid CAS Name: 1-[(2S)-2-aminopropyl]-2H-indazol-6-one; (E)-2-butenedioic acid IUPAC Name: 1-[(2S)-2-aminopropyl]-2H-indazol-6-one; (E)-but-2-enedioic acid Traditional Name: 1-[(2S)-2-aminopropyl]-2H-indazol-6-one; fumaric acid Formula: C14H17N3O5 MolecularWeight: 307.30188

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Descriptors Computed from Structure

Canonical SMILES:

CC(CN1C2=CC(=O)C=CC2=CN1)N.C(=CC(=O)O)C(=O)O

Isomeric SMILES

C[C@@H](CN1C2=CC(=O)C=CC2=CN1)N.C(=C/C(=O)O)\C(=O)O

InChI

InChI=1S/C10H13N3O.C4H4O4/c1-7(11)6-13-10-4-9(14)3-2-8(10)5-12-13;5-3(6)1-2-4(7)8/h2-5,7,12H,6,11H2,1H3;1-2H,(H,5,6)(H,7,8)/b;2-1+/t7-;/m0./s1