4-[[1-[(E)-2-(4-benzamidopyridin-3-yl)ethenyl]indazol-5-yl]carbamoyl]benzoic acid

Systemtic Name: 4-[[1-[(E)-2-(4-benzamidopyridin-3-yl)ethenyl]indazol-5-yl]carbamoyl]benzoic acid Openeye Name: 4-[[1-[(E)-2-(4-benzamido-3-pyridyl)vinyl]indazol-5-yl]carbamoyl]benzoic acid CAS Name: 4-[[[1-[(E)-2-(4-benzamido-3-pyridinyl)ethenyl]-5-indazolyl]amino]-oxomethyl]benzoic acid IUPAC Name: 4-[[1-[(E)-2-(4-benzamidopyridin-3-yl)ethenyl]indazol-5-yl]carbamoyl]benzoic acid Traditional Name: 4-[[1-[(E)-2-(4-benzamido-3-pyridyl)vinyl]indazol-5-yl]carbamoyl]benzoic acid Formula: C29H21N5O4 MolecularWeight: 503.50814

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)C(=O)NC2=C(C=NC=C2)C=CN3C4=C(C=C(C=C4)NC(=O)C5=CC=C(C=C5)C(=O)O)C=N3

Isomeric SMILES

C1=CC=C(C=C1)C(=O)NC2=C(C=NC=C2)/C=C/N3C4=C(C=C(C=C4)NC(=O)C5=CC=C(C=C5)C(=O)O)C=N3

InChI

InChI=1S/C29H21N5O4/c35-27(20-6-8-21(9-7-20)29(37)38)32-24-10-11-26-23(16-24)18-31-34(26)15-13-22-17-30-14-12-25(22)33-28(36)19-4-2-1-3-5-19/h1-18H,(H,32,35)(H,37,38)(H,30,33,36)/b15-13+