diethyl-[3-[(4-methoxyphenyl)methyl-(4-nitrophenyl)carbonyl-amino]propyl]-methyl-azanium bromide

Systemtic Name: diethyl-[3-[(4-methoxyphenyl)methyl-(4-nitrophenyl)carbonyl-amino]propyl]-methyl-azanium bromide Openeye Name: diethyl-[3-[(4-methoxyphenyl)methyl-(4-nitrobenzoyl)amino]propyl]-methyl-ammonium bromide CAS Name: diethyl-[3-[(4-methoxyphenyl)methyl-[(4-nitrophenyl)-oxomethyl]amino]propyl]-methylammonium bromide IUPAC Name: diethyl-[3-[(4-methoxyphenyl)methyl-(4-nitrobenzoyl)amino]propyl]-methylazanium bromide Traditional Name: diethyl-methyl-[3-[(4-nitrobenzoyl)-p-anisyl-amino]propyl]ammonium bromide Formula: C23H32BrN3O4 MolecularWeight: 494.42188

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Descriptors Computed from Structure

Canonical SMILES:

CC[N+](C)(CC)CCCN(CC1=CC=C(C=C1)OC)C(=O)C2=CC=C(C=C2)[N+](=O)[O-].[Br-]

Isomeric SMILES

CC[N+](C)(CC)CCCN(CC1=CC=C(C=C1)OC)C(=O)C2=CC=C(C=C2)[N+](=O)[O-].[Br-]

InChI

InChI=1S/C23H32N3O4.BrH/c1-5-26(3,6-2)17-7-16-24(18-19-8-14-22(30-4)15-9-19)23(27)20-10-12-21(13-11-20)25(28)29;/h8-15H,5-7,16-18H2,1-4H3;1H/q+1;/p-1