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3-[(4-ethanoyl-2-nitro-phenyl)amino]propyl-methyl-(phenylmethyl)azanium

3-[(4-ethanoyl-2-nitro-phenyl)amino]propyl-methyl-(phenylmethyl)azanium

Systemtic Name:3-[(4-ethanoyl-2-nitro-phenyl)amino]propyl-methyl-(phenylmethyl)azanium
Openeye Name:3-(4-acetyl-2-nitro-anilino)propyl-benzyl-methyl-ammonium
CAS Name:3-(4-acetyl-2-nitroanilino)propyl-methyl-(phenylmethyl)ammonium
IUPAC Name:3-(4-acetyl-2-nitroanilino)propyl-benzyl-methylazanium
Traditional Name:3-(4-acetyl-2-nitro-anilino)propyl-benzyl-methyl-ammonium
Formula: C19H24N3O3+
MolecularWeight: 342.41216
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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=C(C=C1)NCCC[NH+](C)CC2=CC=CC=C2)[N+](=O)[O-]


Isomeric SMILES

CC(=O)C1=CC(=C(C=C1)NCCC[NH+](C)CC2=CC=CC=C2)[N+](=O)[O-]


InChI

InChI=1S/C19H23N3O3/c1-15(23)17-9-10-18(19(13-17)22(24)25)20-11-6-12-21(2)14-16-7-4-3-5-8-16/h3-5,7-10,13,20H,6,11-12,14H2,1-2H3/p+1


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