N-(2-hydroxyethyl)-4-[[1-[(4-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]amino]-3,5-dinitro-benzamide

Systemtic Name: N-(2-hydroxyethyl)-4-[[1-[(4-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]amino]-3,5-dinitro-benzamide Openeye Name: N-(2-hydroxyethyl)-4-[[2-(4-methoxyanilino)-1-methyl-2-oxo-ethyl]amino]-3,5-dinitro-benzamide CAS Name: N-(2-hydroxyethyl)-4-[[1-(4-methoxyanilino)-1-oxopropan-2-yl]amino]-3,5-dinitrobenzamide IUPAC Name: N-(2-hydroxyethyl)-4-[[1-(4-methoxyanilino)-1-oxopropan-2-yl]amino]-3,5-dinitrobenzamide Traditional Name: N-(2-hydroxyethyl)-4-[[2-keto-1-methyl-2-(p-anisidino)ethyl]amino]-3,5-dinitro-benzamide Formula: C19H21N5O8 MolecularWeight: 447.39874

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OC)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)NCCO)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OC)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)NCCO)[N+](=O)[O-]

InChI

InChI=1S/C19H21N5O8/c1-11(18(26)22-13-3-5-14(32-2)6-4-13)21-17-15(23(28)29)9-12(10-16(17)24(30)31)19(27)20-7-8-25/h3-6,9-11,21,25H,7-8H2,1-2H3,(H,20,27)(H,22,26)