[2-[4-(4-chlorophenyl)carbonylphenoxy]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium

Systemtic Name: [2-[4-(4-chlorophenyl)carbonylphenoxy]-2-oxidanylidene-ethyl]-methyl-[2-oxidanylidene-2-(propan-2-ylamino)ethyl]azanium Openeye Name: [2-[4-(4-chlorobenzoyl)phenoxy]-2-oxo-ethyl]-[2-(isopropylamino)-2-oxo-ethyl]-methyl-ammonium CAS Name: [2-[4-[(4-chlorophenyl)-oxomethyl]phenoxy]-2-oxoethyl]-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]ammonium IUPAC Name: [2-[4-(4-chlorobenzoyl)phenoxy]-2-oxoethyl]-methyl-[2-oxo-2-(propan-2-ylamino)ethyl]azanium Traditional Name: [2-[4-(4-chlorobenzoyl)phenoxy]-2-keto-ethyl]-[2-(isopropylamino)-2-keto-ethyl]-methyl-ammonium Formula: C21H24ClN2O4+ MolecularWeight: 403.87926

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)NC(=O)C[NH+](C)CC(=O)OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl

Isomeric SMILES

CC(C)NC(=O)C[NH+](C)CC(=O)OC1=CC=C(C=C1)C(=O)C2=CC=C(C=C2)Cl

InChI

InChI=1S/C21H23ClN2O4/c1-14(2)23-19(25)12-24(3)13-20(26)28-18-10-6-16(7-11-18)21(27)15-4-8-17(22)9-5-15/h4-11,14H,12-13H2,1-3H3,(H,23,25)/p+1