3-[(2-chlorophenyl)-(2-methylphenyl)carbonyl-amino]propylazanium

Systemtic Name: 3-[(2-chlorophenyl)-(2-methylphenyl)carbonyl-amino]propylazanium Openeye Name: 3-(2-chloro-N-(2-methylbenzoyl)anilino)propylammonium CAS Name: 3-(2-chloro-N-[(2-methylphenyl)-oxomethyl]anilino)propylammonium IUPAC Name: 3-(2-chloro-N-(2-methylbenzoyl)anilino)propylazanium Traditional Name: 3-(2-chloro-N-o-toluoyl-anilino)propylammonium Formula: C17H20ClN2O+ MolecularWeight: 303.8065

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)N(CCC[NH3+])C2=CC=CC=C2Cl

Isomeric SMILES

CC1=CC=CC=C1C(=O)N(CCC[NH3+])C2=CC=CC=C2Cl

InChI

InChI=1S/C17H19ClN2O/c1-13-7-2-3-8-14(13)17(21)20(12-6-11-19)16-10-5-4-9-15(16)18/h2-5,7-10H,6,11-12,19H2,1H3/p+1