N-[1-[(2E)-2-butan-2-ylidenehydrazinyl]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-3,5-dinitro-benzamide

Systemtic Name: N-[1-[(2E)-2-butan-2-ylidenehydrazinyl]-3-(4-hydroxyphenyl)-1-oxidanylidene-propan-2-yl]-3,5-dinitro-benzamide Openeye Name: N-[1-[(4-hydroxyphenyl)methyl]-2-[(2E)-2-(1-methylpropylidene)hydrazino]-2-oxo-ethyl]-3,5-dinitro-benzamide CAS Name: N-[1-[(2E)-2-butan-2-ylidenehydrazinyl]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-3,5-dinitrobenzamide IUPAC Name: N-[1-[(2E)-2-butan-2-ylidenehydrazinyl]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]-3,5-dinitrobenzamide Traditional Name: N-[1-(4-hydroxybenzyl)-2-keto-2-[(N'E)-N'-(1-methylpropylidene)hydrazino]ethyl]-3,5-dinitro-benzamide Formula: C20H21N5O7 MolecularWeight: 443.41004

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=NNC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])C

Isomeric SMILES

CC/C(=N/NC(=O)C(CC1=CC=C(C=C1)O)NC(=O)C2=CC(=CC(=C2)[N+](=O)[O-])[N+](=O)[O-])/C

InChI

InChI=1S/C20H21N5O7/c1-3-12(2)22-23-20(28)18(8-13-4-6-17(26)7-5-13)21-19(27)14-9-15(24(29)30)11-16(10-14)25(31)32/h4-7,9-11,18,26H,3,8H2,1-2H3,(H,21,27)(H,23,28)/b22-12+