[3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-(3-butoxypropyl)azanium

Systemtic Name: [3-bromanyl-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-(3-butoxypropyl)azanium Openeye Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxy-phenyl]methyl-(3-butoxypropyl)ammonium CAS Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl-(3-butoxypropyl)ammonium IUPAC Name: [3-bromo-4-[(4-chlorophenyl)methoxy]-5-ethoxyphenyl]methyl-(3-butoxypropyl)azanium Traditional Name: [3-bromo-4-(4-chlorobenzyl)oxy-5-ethoxy-benzyl]-(3-butoxypropyl)ammonium Formula: C23H32BrClNO3+ MolecularWeight: 485.86208

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Descriptors Computed from Structure

Canonical SMILES:

CCCCOCCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)Cl)OCC

Isomeric SMILES

CCCCOCCC[NH2+]CC1=CC(=C(C(=C1)Br)OCC2=CC=C(C=C2)Cl)OCC

InChI

InChI=1S/C23H31BrClNO3/c1-3-5-12-27-13-6-11-26-16-19-14-21(24)23(22(15-19)28-4-2)29-17-18-7-9-20(25)10-8-18/h7-10,14-15,26H,3-6,11-13,16-17H2,1-2H3/p+1