3-[3-[(2,4,6-trimethylphenyl)carbamoyl]phenoxy]propylazanium

Systemtic Name: 3-[3-[(2,4,6-trimethylphenyl)carbamoyl]phenoxy]propylazanium Openeye Name: 3-[3-[(2,4,6-trimethylphenyl)carbamoyl]phenoxy]propylammonium CAS Name: 3-[3-[oxo-(2,4,6-trimethylanilino)methyl]phenoxy]propylammonium IUPAC Name: 3-[3-[(2,4,6-trimethylphenyl)carbamoyl]phenoxy]propylazanium Traditional Name: 3-[3-(mesitylcarbamoyl)phenoxy]propylammonium Formula: C19H25N2O2+ MolecularWeight: 313.414

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC(=CC=C2)OCCC[NH3+])C

Isomeric SMILES

CC1=CC(=C(C(=C1)C)NC(=O)C2=CC(=CC=C2)OCCC[NH3+])C

InChI

InChI=1S/C19H24N2O2/c1-13-10-14(2)18(15(3)11-13)21-19(22)16-6-4-7-17(12-16)23-9-5-8-20/h4,6-7,10-12H,5,8-9,20H2,1-3H3,(H,21,22)/p+1