2-chloranyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-nitro-benzamide

Systemtic Name: 2-chloranyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-nitro-benzamide Openeye Name: 2-chloro-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-nitro-benzamide CAS Name: 2-chloro-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-5-nitrobenzamide IUPAC Name: 2-chloro-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-5-nitrobenzamide Traditional Name: 2-chloro-N-[2-(morpholin-4-ium-4-ylmethyl)benzyl]-5-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=CC(=C3)[N+](=O)[O-])Cl

Isomeric SMILES

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

InChI

InChI=1S/C19H20ClN3O4/c20-18-6-5-16(23(25)26)11-17(18)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