2-(3-methylbut-2-enoyl)-3-(2-methylpropyl)-5-phenylazanyl-indazole-4,7-dione

Systemtic Name: 2-(3-methylbut-2-enoyl)-3-(2-methylpropyl)-5-phenylazanyl-indazole-4,7-dione Openeye Name: 5-anilino-3-isobutyl-2-(3-methylbut-2-enoyl)indazole-4,7-dione CAS Name: 5-anilino-2-(3-methyl-1-oxobut-2-enyl)-3-(2-methylpropyl)indazole-4,7-dione IUPAC Name: 5-anilino-2-(3-methylbut-2-enoyl)-3-(2-methylpropyl)indazole-4,7-dione Traditional Name: 5-anilino-3-isobutyl-2-(3-methylbut-2-enoyl)indazole-4,7-quinone Formula: C22H23N3O3 MolecularWeight: 377.43632

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC1=C2C(=NN1C(=O)C=C(C)C)C(=O)C=C(C2=O)NC3=CC=CC=C3

Isomeric SMILES

CC(C)CC1=C2C(=NN1C(=O)C=C(C)C)C(=O)C=C(C2=O)NC3=CC=CC=C3

InChI

InChI=1S/C22H23N3O3/c1-13(2)10-17-20-21(24-25(17)19(27)11-14(3)4)18(26)12-16(22(20)28)23-15-8-6-5-7-9-15/h5-9,11-13,23H,10H2,1-4H3