5-chloranyl-N-[4-(2-diethylaminoethyloxy)phenyl]-2,4-dinitro-aniline

Systemtic Name: 5-chloranyl-N-[4-(2-diethylaminoethyloxy)phenyl]-2,4-dinitro-aniline Openeye Name: 5-chloro-N-[4-(2-diethylaminoethyloxy)phenyl]-2,4-dinitro-aniline CAS Name: 5-chloro-N-[4-(2-diethylaminoethyloxy)phenyl]-2,4-dinitroaniline IUPAC Name: 5-chloro-N-[4-(2-diethylaminoethyloxy)phenyl]-2,4-dinitroaniline Traditional Name: 2-[4-(5-chloro-2,4-dinitro-anilino)phenoxy]ethyl-diethyl-amine Formula: C18H21ClN4O5 MolecularWeight: 408.83614

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCOC1=CC=C(C=C1)NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])Cl

Isomeric SMILES

CCN(CC)CCOC1=CC=C(C=C1)NC2=CC(=C(C=C2[N+](=O)[O-])[N+](=O)[O-])Cl

InChI

InChI=1S/C18H21ClN4O5/c1-3-21(4-2)9-10-28-14-7-5-13(6-8-14)20-16-11-15(19)17(22(24)25)12-18(16)23(26)27/h5-8,11-12,20H,3-4,9-10H2,1-2H3