(E)-3-[1-methyl-5-[(triphenylmethyl)amino]pyrazol-4-yl]prop-2-enoic acid

Systemtic Name: (E)-3-[1-methyl-5-[(triphenylmethyl)amino]pyrazol-4-yl]prop-2-enoic acid Openeye Name: (E)-3-[1-methyl-5-(tritylamino)pyrazol-4-yl]prop-2-enoic acid CAS Name: (E)-3-[1-methyl-5-[(triphenylmethyl)amino]-4-pyrazolyl]-2-propenoic acid IUPAC Name: (E)-3-[1-methyl-5-(tritylamino)pyrazol-4-yl]prop-2-enoic acid Traditional Name: (E)-3-[1-methyl-5-(tritylamino)pyrazol-4-yl]acrylic acid Formula: C26H23N3O2 MolecularWeight: 409.47972

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=C(C=N1)C=CC(=O)O)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

Isomeric SMILES

CN1C(=C(C=N1)/C=C/C(=O)O)NC(C2=CC=CC=C2)(C3=CC=CC=C3)C4=CC=CC=C4

InChI

InChI=1S/C26H23N3O2/c1-29-25(20(19-27-29)17-18-24(30)31)28-26(21-11-5-2-6-12-21,22-13-7-3-8-14-22)23-15-9-4-10-16-23/h2-19,28H,1H3,(H,30,31)/b18-17+