N,N-diethyl-2-[[(6R)-1-[(4-methoxyphenyl)methyl]-2-oxidanylidene-4-propan-2-yl-1,4-diazepan-4-ium-6-yl]oxy]ethanamide

Systemtic Name: N,N-diethyl-2-[[(6R)-1-[(4-methoxyphenyl)methyl]-2-oxidanylidene-4-propan-2-yl-1,4-diazepan-4-ium-6-yl]oxy]ethanamide Openeye Name: N,N-diethyl-2-[[(6R)-4-isopropyl-1-[(4-methoxyphenyl)methyl]-2-oxo-1,4-diazepan-4-ium-6-yl]oxy]acetamide CAS Name: N,N-diethyl-2-[[(6R)-1-[(4-methoxyphenyl)methyl]-2-oxo-4-propan-2-yl-1,4-diazepan-4-ium-6-yl]oxy]acetamide IUPAC Name: N,N-diethyl-2-[[(6R)-1-[(4-methoxyphenyl)methyl]-2-oxo-4-propan-2-yl-1,4-diazepan-4-ium-6-yl]oxy]acetamide Traditional Name: N,N-diethyl-2-[[(6R)-4-isopropyl-2-keto-1-p-anisyl-1,4-diazepan-4-ium-6-yl]oxy]acetamide Formula: C22H36N3O4+ MolecularWeight: 406.53894

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)C(=O)COC1C[NH+](CC(=O)N(C1)CC2=CC=C(C=C2)OC)C(C)C

Isomeric SMILES

CCN(CC)C(=O)CO[C@H]1C[NH+](CC(=O)N(C1)CC2=CC=C(C=C2)OC)C(C)C

InChI

InChI=1S/C22H35N3O4/c1-6-23(7-2)22(27)16-29-20-13-24(17(3)4)15-21(26)25(14-20)12-18-8-10-19(28-5)11-9-18/h8-11,17,20H,6-7,12-16H2,1-5H3/p+1/t20-/m0/s1