(4Z)-4-[[(1S,2S,4R)-2,4-dinitrocyclohexyl]hydrazinylidene]-1-indol-1-yl-pentan-1-one

Systemtic Name: (4Z)-4-[[(1S,2S,4R)-2,4-dinitrocyclohexyl]hydrazinylidene]-1-indol-1-yl-pentan-1-one Openeye Name: (4Z)-4-[[(1S,2S,4R)-2,4-dinitrocyclohexyl]hydrazono]-1-indol-1-yl-pentan-1-one CAS Name: (4Z)-4-[[(1S,2S,4R)-2,4-dinitrocyclohexyl]hydrazinylidene]-1-(1-indolyl)-1-pentanone IUPAC Name: (4Z)-4-[[(1S,2S,4R)-2,4-dinitrocyclohexyl]hydrazinylidene]-1-indol-1-ylpentan-1-one Traditional Name: (4Z)-4-[[(1S,2S,4R)-2,4-dinitrocyclohexyl]hydrazono]-1-indol-1-yl-pentan-1-one Formula: C19H23N5O5 MolecularWeight: 401.41642

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC1CCC(CC1[N+](=O)[O-])[N+](=O)[O-])CCC(=O)N2C=CC3=CC=CC=C32

Isomeric SMILES

C/C(=N/N[C@H]1CC[C@H](C[C@@H]1[N+](=O)[O-])[N+](=O)[O-])/CCC(=O)N2C=CC3=CC=CC=C32

InChI

InChI=1S/C19H23N5O5/c1-13(6-9-19(25)22-11-10-14-4-2-3-5-17(14)22)20-21-16-8-7-15(23(26)27)12-18(16)24(28)29/h2-5,10-11,15-16,18,21H,6-9,12H2,1H3/b20-13-/t15-,16+,18+/m1/s1