3-[[4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxidanylidene-butanoyl]amino]propyl-diethyl-azanium

Systemtic Name: 3-[[4-[4-(diphenylmethyl)piperazin-1-yl]-4-oxidanylidene-butanoyl]amino]propyl-diethyl-azanium Openeye Name: 3-[[4-(4-benzhydrylpiperazin-1-yl)-4-oxo-butanoyl]amino]propyl-diethyl-ammonium CAS Name: 3-[[4-[4-(diphenylmethyl)-1-piperazinyl]-1,4-dioxobutyl]amino]propyl-diethylammonium IUPAC Name: 3-[[4-(4-benzhydrylpiperazin-1-yl)-4-oxobutanoyl]amino]propyl-diethylazanium Traditional Name: 3-[[4-(4-benzhydrylpiperazino)-4-keto-butanoyl]amino]propyl-diethyl-ammonium Formula: C28H41N4O2+ MolecularWeight: 465.65074

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CCCNC(=O)CCC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

Isomeric SMILES

CC[NH+](CC)CCCNC(=O)CCC(=O)N1CCN(CC1)C(C2=CC=CC=C2)C3=CC=CC=C3

InChI

InChI=1S/C28H40N4O2/c1-3-30(4-2)19-11-18-29-26(33)16-17-27(34)31-20-22-32(23-21-31)28(24-12-7-5-8-13-24)25-14-9-6-10-15-25/h5-10,12-15,28H,3-4,11,16-23H2,1-2H3,(H,29,33)/p+1