methyl-[3-[(3-methyl-2-nitro-phenyl)carbonylamino]propyl]-(phenylmethyl)azanium

Systemtic Name: methyl-[3-[(3-methyl-2-nitro-phenyl)carbonylamino]propyl]-(phenylmethyl)azanium Openeye Name: benzyl-methyl-[3-[(3-methyl-2-nitro-benzoyl)amino]propyl]ammonium CAS Name: methyl-[3-[[(3-methyl-2-nitrophenyl)-oxomethyl]amino]propyl]-(phenylmethyl)ammonium IUPAC Name: benzyl-methyl-[3-[(3-methyl-2-nitrobenzoyl)amino]propyl]azanium Traditional Name: benzyl-methyl-[3-[(3-methyl-2-nitro-benzoyl)amino]propyl]ammonium Formula: C19H24N3O3+ MolecularWeight: 342.41216

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCCC[NH+](C)CC2=CC=CC=C2

Isomeric SMILES

CC1=CC=CC(=C1[N+](=O)[O-])C(=O)NCCC[NH+](C)CC2=CC=CC=C2

InChI

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