dimethyl-[3-[[4-(2-methylphenyl)carbonyl-1H-pyrrol-2-yl]carbonylamino]propyl]azanium

Systemtic Name: dimethyl-[3-[[4-(2-methylphenyl)carbonyl-1H-pyrrol-2-yl]carbonylamino]propyl]azanium Openeye Name: dimethyl-[3-[[4-(2-methylbenzoyl)-1H-pyrrole-2-carbonyl]amino]propyl]ammonium CAS Name: dimethyl-[3-[[[4-[(2-methylphenyl)-oxomethyl]-1H-pyrrol-2-yl]-oxomethyl]amino]propyl]ammonium IUPAC Name: dimethyl-[3-[[4-(2-methylbenzoyl)-1H-pyrrole-2-carbonyl]amino]propyl]azanium Traditional Name: dimethyl-[3-[(4-o-toluoyl-1H-pyrrole-2-carbonyl)amino]propyl]ammonium Formula: C18H24N3O2+ MolecularWeight: 314.40206

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C18H23N3O2/c1-13-7-4-5-8-15(13)17(22)14-11-16(20-12-14)18(23)19-9-6-10-21(2)3/h4-5,7-8,11-12,20H,6,9-10H2,1-3H3,(H,19,23)/p+1