dimethyl-[[4-[[3-[(2-methylphenyl)carbonylamino]propanoylamino]methyl]phenyl]methyl]azanium

Systemtic Name: dimethyl-[[4-[[3-[(2-methylphenyl)carbonylamino]propanoylamino]methyl]phenyl]methyl]azanium Openeye Name: dimethyl-[[4-[[3-[(2-methylbenzoyl)amino]propanoylamino]methyl]phenyl]methyl]ammonium CAS Name: dimethyl-[[4-[[[3-[[(2-methylphenyl)-oxomethyl]amino]-1-oxopropyl]amino]methyl]phenyl]methyl]ammonium IUPAC Name: dimethyl-[[4-[[3-[(2-methylbenzoyl)amino]propanoylamino]methyl]phenyl]methyl]azanium Traditional Name: dimethyl-[4-[[3-(o-toluoylamino)propanoylamino]methyl]benzyl]ammonium Formula: C21H28N3O2+ MolecularWeight: 354.46592

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NCCC(=O)NCC2=CC=C(C=C2)C[NH+](C)C

Isomeric SMILES

CC1=CC=CC=C1C(=O)NCCC(=O)NCC2=CC=C(C=C2)C[NH+](C)C

InChI

InChI=1S/C21H27N3O2/c1-16-6-4-5-7-19(16)21(26)22-13-12-20(25)23-14-17-8-10-18(11-9-17)15-24(2)3/h4-11H,12-15H2,1-3H3,(H,22,26)(H,23,25)/p+1