5-[[4-[2-chloranylpropyl(ethyl)amino]phenyl]amino]-2,4-dinitro-benzamide

Systemtic Name: 5-[[4-[2-chloranylpropyl(ethyl)amino]phenyl]amino]-2,4-dinitro-benzamide Openeye Name: 5-[4-[2-chloropropyl(ethyl)amino]anilino]-2,4-dinitro-benzamide CAS Name: 5-[4-[2-chloropropyl(ethyl)amino]anilino]-2,4-dinitrobenzamide IUPAC Name: 5-[4-[2-chloropropyl(ethyl)amino]anilino]-2,4-dinitrobenzamide Traditional Name: 5-[4-[2-chloropropyl(ethyl)amino]anilino]-2,4-dinitro-benzamide Formula: C18H20ClN5O5 MolecularWeight: 421.8349

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC(C)Cl)C1=CC=C(C=C1)NC2=C(C=C(C(=C2)C(=O)N)[N+](=O)[O-])[N+](=O)[O-]

Isomeric SMILES

CCN(CC(C)Cl)C1=CC=C(C=C1)NC2=C(C=C(C(=C2)C(=O)N)[N+](=O)[O-])[N+](=O)[O-]

InChI

InChI=1S/C18H20ClN5O5/c1-3-22(10-11(2)19)13-6-4-12(5-7-13)21-15-8-14(18(20)25)16(23(26)27)9-17(15)24(28)29/h4-9,11,21H,3,10H2,1-2H3,(H2,20,25)