[3-(diethylazaniumyl)-2-[(4-ethoxy-2-nitro-phenyl)carbamoyloxy]propyl]-diethyl-azanium

Systemtic Name: [3-(diethylazaniumyl)-2-[(4-ethoxy-2-nitro-phenyl)carbamoyloxy]propyl]-diethyl-azanium Openeye Name: [3-(diethylammonio)-2-[(4-ethoxy-2-nitro-phenyl)carbamoyloxy]propyl]-diethyl-ammonium CAS Name: [3-(diethylammonio)-2-[(4-ethoxy-2-nitroanilino)-oxomethoxy]propyl]-diethylammonium IUPAC Name: [3-(diethylazaniumyl)-2-[(4-ethoxy-2-nitrophenyl)carbamoyloxy]propyl]-diethylazanium Traditional Name: [3-(diethylammonio)-2-[(4-ethoxy-2-nitro-phenyl)carbamoyloxy]propyl]-diethyl-ammonium Formula: C20H36N4O5+2 MolecularWeight: 412.52364

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC(C[NH+](CC)CC)OC(=O)NC1=C(C=C(C=C1)OCC)[N+](=O)[O-]

Isomeric SMILES

CC[NH+](CC)CC(C[NH+](CC)CC)OC(=O)NC1=C(C=C(C=C1)OCC)[N+](=O)[O-]

InChI

InChI=1S/C20H34N4O5/c1-6-22(7-2)14-17(15-23(8-3)9-4)29-20(25)21-18-12-11-16(28-10-5)13-19(18)24(26)27/h11-13,17H,6-10,14-15H2,1-5H3,(H,21,25)/p+2