(E)-3-(1-cyclohexyl-5-phenyl-pyrazol-3-yl)prop-2-enoic acid

Systemtic Name: (E)-3-(1-cyclohexyl-5-phenyl-pyrazol-3-yl)prop-2-enoic acid Openeye Name: (E)-3-(1-cyclohexyl-5-phenyl-pyrazol-3-yl)prop-2-enoic acid CAS Name: (E)-3-(1-cyclohexyl-5-phenyl-3-pyrazolyl)-2-propenoic acid IUPAC Name: (E)-3-(1-cyclohexyl-5-phenylpyrazol-3-yl)prop-2-enoic acid Traditional Name: (E)-3-(1-cyclohexyl-5-phenyl-pyrazol-3-yl)acrylic acid Formula: C18H20N2O2 MolecularWeight: 296.3636

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)N2C(=CC(=N2)C=CC(=O)O)C3=CC=CC=C3

Isomeric SMILES

C1CCC(CC1)N2C(=CC(=N2)/C=C/C(=O)O)C3=CC=CC=C3

InChI

InChI=1S/C18H20N2O2/c21-18(22)12-11-15-13-17(14-7-3-1-4-8-14)20(19-15)16-9-5-2-6-10-16/h1,3-4,7-8,11-13,16H,2,5-6,9-10H2,(H,21,22)/b12-11+