2-[[2-cyano-3-oxidanylidene-3-(1-phenyl-4H-indeno[1,2-c]pyrazol-3-yl)propanoyl]amino]-4-methyl-pentanoic acid

Systemtic Name: 2-[[2-cyano-3-oxidanylidene-3-(1-phenyl-4H-indeno[1,2-c]pyrazol-3-yl)propanoyl]amino]-4-methyl-pentanoic acid Openeye Name: 2-[[2-cyano-3-oxo-3-(1-phenyl-4H-indeno[1,2-c]pyrazol-3-yl)propanoyl]amino]-4-methyl-pentanoic acid CAS Name: 2-[[2-cyano-1,3-dioxo-3-(1-phenyl-4H-indeno[1,2-c]pyrazol-3-yl)propyl]amino]-4-methylpentanoic acid IUPAC Name: 2-[[2-cyano-3-oxo-3-(1-phenyl-4H-indeno[1,2-c]pyrazol-3-yl)propanoyl]amino]-4-methylpentanoic acid Traditional Name: 2-[[2-cyano-3-keto-3-(1-phenyl-4H-indeno[1,2-c]pyrazol-3-yl)propanoyl]amino]-4-methyl-valeric acid Formula: C26H24N4O4 MolecularWeight: 456.49316

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)O)NC(=O)C(C#N)C(=O)C1=NN(C2=C1CC3=CC=CC=C32)C4=CC=CC=C4

Isomeric SMILES

CC(C)CC(C(=O)O)NC(=O)C(C#N)C(=O)C1=NN(C2=C1CC3=CC=CC=C32)C4=CC=CC=C4

InChI

InChI=1S/C26H24N4O4/c1-15(2)12-21(26(33)34)28-25(32)20(14-27)24(31)22-19-13-16-8-6-7-11-18(16)23(19)30(29-22)17-9-4-3-5-10-17/h3-11,15,20-21H,12-13H2,1-2H3,(H,28,32)(H,33,34)