2-[[4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoylamino]phenyl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[4-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethanoylamino]phenyl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[4-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]benzoyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[4-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)-1-oxoethyl]amino]phenyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[4-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]benzoyl]amino]ethyl-diethylazanium Traditional Name: 2-[[4-[[2-(2,3-dihydro-1,4-benzodioxin-6-yl)acetyl]amino]benzoyl]amino]ethyl-diethyl-ammonium Formula: C23H30N3O4+ MolecularWeight: 412.502

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)CC2=CC3=C(C=C2)OCCO3

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)CC2=CC3=C(C=C2)OCCO3

InChI

InChI=1S/C23H29N3O4/c1-3-26(4-2)12-11-24-23(28)18-6-8-19(9-7-18)25-22(27)16-17-5-10-20-21(15-17)30-14-13-29-20/h5-10,15H,3-4,11-14,16H2,1-2H3,(H,24,28)(H,25,27)/p+1