4-[(2E)-2-[[1-(2-cyanoethyl)-4-methyl-pyrazol-3-yl]methylidene]hydrazinyl]benzoic acid

Systemtic Name: 4-[(2E)-2-[[1-(2-cyanoethyl)-4-methyl-pyrazol-3-yl]methylidene]hydrazinyl]benzoic acid Openeye Name: 4-[(2E)-2-[[1-(2-cyanoethyl)-4-methyl-pyrazol-3-yl]methylene]hydrazino]benzoic acid CAS Name: 4-[(2E)-2-[[1-(2-cyanoethyl)-4-methyl-3-pyrazolyl]methylidene]hydrazinyl]benzoic acid IUPAC Name: 4-[(2E)-2-[[1-(2-cyanoethyl)-4-methylpyrazol-3-yl]methylidene]hydrazinyl]benzoic acid Traditional Name: 4-[(N'E)-N'-[[1-(2-cyanoethyl)-4-methyl-pyrazol-3-yl]methylene]hydrazino]benzoic acid Formula: C15H15N5O2 MolecularWeight: 297.3119

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(N=C1C=NNC2=CC=C(C=C2)C(=O)O)CCC#N

Isomeric SMILES

CC1=CN(N=C1/C=N/NC2=CC=C(C=C2)C(=O)O)CCC#N

InChI

InChI=1S/C15H15N5O2/c1-11-10-20(8-2-7-16)19-14(11)9-17-18-13-5-3-12(4-6-13)15(21)22/h3-6,9-10,18H,2,8H2,1H3,(H,21,22)/b17-9+