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

Systemtic Name: N-(2-hydroxyethyl)-4-[[1-[(4-methoxyphenyl)amino]-1-oxidanylidene-propan-2-yl]-methyl-amino]-3,5-dinitro-benzamide Openeye Name: N-(2-hydroxyethyl)-4-[[2-(4-methoxyanilino)-1-methyl-2-oxo-ethyl]-methyl-amino]-3,5-dinitro-benzamide CAS Name: N-(2-hydroxyethyl)-4-[[1-(4-methoxyanilino)-1-oxopropan-2-yl]-methylamino]-3,5-dinitrobenzamide IUPAC Name: N-(2-hydroxyethyl)-4-[[1-(4-methoxyanilino)-1-oxopropan-2-yl]-methylamino]-3,5-dinitrobenzamide Traditional Name: N-(2-hydroxyethyl)-4-[[2-keto-1-methyl-2-(p-anisidino)ethyl]-methyl-amino]-3,5-dinitro-benzamide Formula: C20H23N5O8 MolecularWeight: 461.42532

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

InChI

InChI=1S/C20H23N5O8/c1-12(19(27)22-14-4-6-15(33-3)7-5-14)23(2)18-16(24(29)30)10-13(11-17(18)25(31)32)20(28)21-8-9-26/h4-7,10-12,26H,8-9H2,1-3H3,(H,21,28)(H,22,27)