N-(2-hydroxyethyl)-4-[[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]amino]-3,5-dinitro-benzamide

Systemtic Name: N-(2-hydroxyethyl)-4-[[2-[(4-methoxyphenyl)amino]-2-oxidanylidene-ethyl]amino]-3,5-dinitro-benzamide Openeye Name: N-(2-hydroxyethyl)-4-[[2-(4-methoxyanilino)-2-oxo-ethyl]amino]-3,5-dinitro-benzamide CAS Name: N-(2-hydroxyethyl)-4-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-3,5-dinitrobenzamide IUPAC Name: N-(2-hydroxyethyl)-4-[[2-(4-methoxyanilino)-2-oxoethyl]amino]-3,5-dinitrobenzamide Traditional Name: N-(2-hydroxyethyl)-4-[[2-keto-2-(p-anisidino)ethyl]amino]-3,5-dinitro-benzamide Formula: C18H19N5O8 MolecularWeight: 433.37216

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)NC(=O)CNC2=C(C=C(C=C2[N+](=O)[O-])C(=O)NCCO)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)NC(=O)CNC2=C(C=C(C=C2[N+](=O)[O-])C(=O)NCCO)[N+](=O)[O-]

InChI

InChI=1S/C18H19N5O8/c1-31-13-4-2-12(3-5-13)21-16(25)10-20-17-14(22(27)28)8-11(9-15(17)23(29)30)18(26)19-6-7-24/h2-5,8-9,20,24H,6-7,10H2,1H3,(H,19,26)(H,21,25)