2-[[(E)-2-benzamido-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enoyl]amino]ethanoic acid

Systemtic Name: 2-[[(E)-2-benzamido-3-(1-phenyl-3-pyridin-3-yl-pyrazol-4-yl)prop-2-enoyl]amino]ethanoic acid Openeye Name: 2-[[(E)-2-benzamido-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]prop-2-enoyl]amino]acetic acid CAS Name: 2-[[(E)-2-benzamido-1-oxo-3-[1-phenyl-3-(3-pyridinyl)-4-pyrazolyl]prop-2-enyl]amino]acetic acid IUPAC Name: 2-[[(E)-2-benzamido-3-(1-phenyl-3-pyridin-3-ylpyrazol-4-yl)prop-2-enoyl]amino]acetic acid Traditional Name: 2-[[(E)-2-benzamido-3-[1-phenyl-3-(3-pyridyl)pyrazol-4-yl]acryloyl]amino]acetic acid Formula: C26H21N5O4 MolecularWeight: 467.47604

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC(=CC2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)C(=O)NCC(=O)O

Isomeric SMILES

C1=CC=C(C=C1)C(=O)N/C(=C/C2=CN(N=C2C3=CN=CC=C3)C4=CC=CC=C4)/C(=O)NCC(=O)O

InChI

InChI=1S/C26H21N5O4/c32-23(33)16-28-26(35)22(29-25(34)18-8-3-1-4-9-18)14-20-17-31(21-11-5-2-6-12-21)30-24(20)19-10-7-13-27-15-19/h1-15,17H,16H2,(H,28,35)(H,29,34)(H,32,33)/b22-14+