2-[[4-[(6-chloranyl-2H-chromen-3-yl)carbonylamino]phenyl]carbonylamino]ethyl-diethyl-azanium

Systemtic Name: 2-[[4-[(6-chloranyl-2H-chromen-3-yl)carbonylamino]phenyl]carbonylamino]ethyl-diethyl-azanium Openeye Name: 2-[[4-[(6-chloro-2H-chromene-3-carbonyl)amino]benzoyl]amino]ethyl-diethyl-ammonium CAS Name: 2-[[[4-[[(6-chloro-2H-1-benzopyran-3-yl)-oxomethyl]amino]phenyl]-oxomethyl]amino]ethyl-diethylammonium IUPAC Name: 2-[[4-[(6-chloro-2H-chromene-3-carbonyl)amino]benzoyl]amino]ethyl-diethylazanium Traditional Name: 2-[[4-[(6-chloro-2H-chromene-3-carbonyl)amino]benzoyl]amino]ethyl-diethyl-ammonium Formula: C23H27ClN3O3+ MolecularWeight: 428.93178

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2

Isomeric SMILES

CC[NH+](CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2=CC3=C(C=CC(=C3)Cl)OC2

InChI

InChI=1S/C23H26ClN3O3/c1-3-27(4-2)12-11-25-22(28)16-5-8-20(9-6-16)26-23(29)18-13-17-14-19(24)7-10-21(17)30-15-18/h5-10,13-14H,3-4,11-12,15H2,1-2H3,(H,25,28)(H,26,29)/p+1