4-chloranyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitro-benzamide

Systemtic Name: 4-chloranyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitro-benzamide Openeye Name: 4-chloro-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitro-benzamide CAS Name: 4-chloro-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-2-nitrobenzamide IUPAC Name: 4-chloro-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitrobenzamide Traditional Name: 4-chloro-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]-2-nitro-benzamide Formula: C19H21ClN3O4+ MolecularWeight: 390.84074

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC(=O)C3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C19H20ClN3O4/c20-16-5-6-17(18(11-16)23(25)26)19(24)21-12-14-3-1-2-4-15(14)13-22-7-9-27-10-8-22/h1-6,11H,7-10,12-13H2,(H,21,24)/p+1