2-[[4-[2-(3,4-dimethylphenoxy)ethanoylamino]phenyl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[4-[2-(3,4-dimethylphenoxy)ethanoylamino]phenyl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[4-[[2-(3,4-dimethylphenoxy)acetyl]amino]benzoyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[4-[[2-(3,4-dimethylphenoxy)-1-oxoethyl]amino]phenyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[4-[[2-(3,4-dimethylphenoxy)acetyl]amino]benzoyl]amino]ethyl-diethylazanium Traditional Name: 2-[[4-[[2-(3,4-dimethylphenoxy)acetyl]amino]benzoyl]amino]ethyl-diethyl-ammonium Formula: C23H32N3O3+ MolecularWeight: 398.51848

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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)C)C

Isomeric SMILES

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

InChI

InChI=1S/C23H31N3O3/c1-5-26(6-2)14-13-24-23(28)19-8-10-20(11-9-19)25-22(27)16-29-21-12-7-17(3)18(4)15-21/h7-12,15H,5-6,13-14,16H2,1-4H3,(H,24,28)(H,25,27)/p+1