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

Systemtic Name: 4-chloranyl-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitro-aniline Openeye Name: 4-chloro-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitro-aniline CAS Name: 4-chloro-N-[[2-(4-morpholin-4-iumylmethyl)phenyl]methyl]-2-nitroaniline IUPAC Name: 4-chloro-N-[[2-(morpholin-4-ium-4-ylmethyl)phenyl]methyl]-2-nitroaniline Traditional Name: (4-chloro-2-nitro-phenyl)-[2-(morpholin-4-ium-4-ylmethyl)benzyl]amine Formula: C18H21ClN3O3+ MolecularWeight: 362.83064

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Descriptors Computed from Structure

Canonical SMILES:

C1COCC[NH+]1CC2=CC=CC=C2CNC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

Isomeric SMILES

C1COCC[NH+]1CC2=CC=CC=C2CNC3=C(C=C(C=C3)Cl)[N+](=O)[O-]

InChI

InChI=1S/C18H20ClN3O3/c19-16-5-6-17(18(11-16)22(23)24)20-12-14-3-1-2-4-15(14)13-21-7-9-25-10-8-21/h1-6,11,20H,7-10,12-13H2/p+1