4-[(2E)-2-[(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylidene]hydrazinyl]benzoic acid

Systemtic Name: 4-[(2E)-2-[(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylidene]hydrazinyl]benzoic acid Openeye Name: 4-[(2E)-2-[(3-methyl-1-phenyl-5-pyrrolidin-1-yl-pyrazol-4-yl)methylene]hydrazino]benzoic acid CAS Name: 4-[(2E)-2-[[3-methyl-1-phenyl-5-(1-pyrrolidinyl)-4-pyrazolyl]methylidene]hydrazinyl]benzoic acid IUPAC Name: 4-[(2E)-2-[(3-methyl-1-phenyl-5-pyrrolidin-1-ylpyrazol-4-yl)methylidene]hydrazinyl]benzoic acid Traditional Name: 4-[(N'E)-N'-[(3-methyl-1-phenyl-5-pyrrolidino-pyrazol-4-yl)methylene]hydrazino]benzoic acid Formula: C22H23N5O2 MolecularWeight: 389.45032

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=NNC2=CC=C(C=C2)C(=O)O)N3CCCC3)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=N/NC2=CC=C(C=C2)C(=O)O)N3CCCC3)C4=CC=CC=C4

InChI

InChI=1S/C22H23N5O2/c1-16-20(15-23-24-18-11-9-17(10-12-18)22(28)29)21(26-13-5-6-14-26)27(25-16)19-7-3-2-4-8-19/h2-4,7-12,15,24H,5-6,13-14H2,1H3,(H,28,29)/b23-15+