(1S,2S)-2-(4-tert-butylphenyl)-N'-(5-nitro-2-oxidanylidene-indol-3-yl)cyclopropane-1-carbohydrazide

Systemtic Name: (1S,2S)-2-(4-tert-butylphenyl)-N'-(5-nitro-2-oxidanylidene-indol-3-yl)cyclopropane-1-carbohydrazide Openeye Name: (1S,2S)-2-(4-tert-butylphenyl)-N'-(5-nitro-2-oxo-indol-3-yl)cyclopropanecarbohydrazide CAS Name: (1S,2S)-2-(4-tert-butylphenyl)-N'-(5-nitro-2-oxo-3-indolyl)-1-cyclopropanecarbohydrazide IUPAC Name: (1S,2S)-2-(4-tert-butylphenyl)-N'-(5-nitro-2-oxoindol-3-yl)cyclopropane-1-carbohydrazide Traditional Name: (1S,2S)-2-(4-tert-butylphenyl)-N'-(2-keto-5-nitro-indol-3-yl)cyclopropanecarbohydrazide Formula: C22H22N4O4 MolecularWeight: 406.43448

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=CC=C(C=C1)C2CC2C(=O)NNC3=C4C=C(C=CC4=NC3=O)[N+](=O)[O-]

Isomeric SMILES

CC(C)(C)C1=CC=C(C=C1)[C@H]2C[C@@H]2C(=O)NNC3=C4C=C(C=CC4=NC3=O)[N+](=O)[O-]

InChI

InChI=1S/C22H22N4O4/c1-22(2,3)13-6-4-12(5-7-13)15-11-16(15)20(27)25-24-19-17-10-14(26(29)30)8-9-18(17)23-21(19)28/h4-10,15-16H,11H2,1-3H3,(H,25,27)(H,23,24,28)/t15-,16+/m1/s1