3-[[(Z)-4-(2-ethoxycarbonyl-3-methyl-1-benzofuran-5-yl)butan-2-ylideneamino]carbamoyl]-1-phenyl-pyrazol-4-olate

Systemtic Name: 3-[[(Z)-4-(2-ethoxycarbonyl-3-methyl-1-benzofuran-5-yl)butan-2-ylideneamino]carbamoyl]-1-phenyl-pyrazol-4-olate Openeye Name: 3-[[(Z)-[3-(2-ethoxycarbonyl-3-methyl-benzofuran-5-yl)-1-methyl-propylidene]amino]carbamoyl]-1-phenyl-pyrazol-4-olate CAS Name: 3-[[(2Z)-2-[4-(2-ethoxycarbonyl-3-methyl-5-benzofuranyl)butan-2-ylidene]hydrazinyl]-oxomethyl]-1-phenyl-4-pyrazololate IUPAC Name: 3-[[(Z)-4-(2-ethoxycarbonyl-3-methyl-1-benzofuran-5-yl)butan-2-ylideneamino]carbamoyl]-1-phenylpyrazol-4-olate Traditional Name: 3-[[(Z)-[3-(2-carbethoxy-3-methyl-benzofuran-5-yl)-1-methyl-propylidene]amino]carbamoyl]-1-phenyl-pyrazol-4-olate Formula: C26H25N4O5- MolecularWeight: 473.5005

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)CCC(=NNC(=O)C3=NN(C=C3[O-])C4=CC=CC=C4)C)C

Isomeric SMILES

CCOC(=O)C1=C(C2=C(O1)C=CC(=C2)CC/C(=N\NC(=O)C3=NN(C=C3[O-])C4=CC=CC=C4)/C)C

InChI

InChI=1S/C26H26N4O5/c1-4-34-26(33)24-17(3)20-14-18(12-13-22(20)35-24)11-10-16(2)27-28-25(32)23-21(31)15-30(29-23)19-8-6-5-7-9-19/h5-9,12-15,31H,4,10-11H2,1-3H3,(H,28,32)/p-1/b27-16-