(E)-4-[1-(2-azanylpropyl)-3-methyl-indazol-6-yl]oxy-4-oxidanylidene-but-2-enoic acid

Systemtic Name: (E)-4-[1-(2-azanylpropyl)-3-methyl-indazol-6-yl]oxy-4-oxidanylidene-but-2-enoic acid Openeye Name: (E)-4-[1-(2-aminopropyl)-3-methyl-indazol-6-yl]oxy-4-oxo-but-2-enoic acid CAS Name: (E)-4-[[1-(2-aminopropyl)-3-methyl-6-indazolyl]oxy]-4-oxo-2-butenoic acid IUPAC Name: (E)-4-[1-(2-aminopropyl)-3-methylindazol-6-yl]oxy-4-oxobut-2-enoic acid Traditional Name: (E)-4-[1-(2-aminopropyl)-3-methyl-indazol-6-yl]oxy-4-keto-but-2-enoic acid Formula: C15H17N3O4 MolecularWeight: 303.31318

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C2=C1C=CC(=C2)OC(=O)C=CC(=O)O)CC(C)N

Isomeric SMILES

CC1=NN(C2=C1C=CC(=C2)OC(=O)/C=C/C(=O)O)CC(C)N

InChI

InChI=1S/C15H17N3O4/c1-9(16)8-18-13-7-11(3-4-12(13)10(2)17-18)22-15(21)6-5-14(19)20/h3-7,9H,8,16H2,1-2H3,(H,19,20)/b6-5+