2-[[4-[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]phenyl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[4-[2-(4-chloranyl-3-methyl-phenoxy)ethanoylamino]phenyl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[4-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]benzoyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[4-[[2-(4-chloro-3-methylphenoxy)-1-oxoethyl]amino]phenyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[4-[[2-(4-chloro-3-methylphenoxy)acetyl]amino]benzoyl]amino]ethyl-diethylazanium Traditional Name: 2-[[4-[[2-(4-chloro-3-methyl-phenoxy)acetyl]amino]benzoyl]amino]ethyl-diethyl-ammonium Formula: C22H29ClN3O3+ MolecularWeight: 418.93696

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC(=C(C=C2)Cl)C

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)COC2=CC(=C(C=C2)Cl)C

InChI

InChI=1S/C22H28ClN3O3/c1-4-26(5-2)13-12-24-22(28)17-6-8-18(9-7-17)25-21(27)15-29-19-10-11-20(23)16(3)14-19/h6-11,14H,4-5,12-13,15H2,1-3H3,(H,24,28)(H,25,27)/p+1