methyl-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]-[(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]azanium

Systemtic Name: methyl-[2-oxidanylidene-2-[4-(phenylmethyl)piperazin-4-ium-1-yl]ethyl]-[(1S)-2-oxidanylidene-1-phenyl-2-pyrrolidin-1-yl-ethyl]azanium Openeye Name: [2-(4-benzylpiperazin-4-ium-1-yl)-2-oxo-ethyl]-methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-yl-ethyl]ammonium CAS Name: methyl-[2-oxo-2-[4-(phenylmethyl)-1-piperazin-4-iumyl]ethyl]-[(1S)-2-oxo-1-phenyl-2-(1-pyrrolidinyl)ethyl]ammonium IUPAC Name: [2-(4-benzylpiperazin-4-ium-1-yl)-2-oxoethyl]-methyl-[(1S)-2-oxo-1-phenyl-2-pyrrolidin-1-ylethyl]azanium Traditional Name: [2-(4-benzylpiperazin-4-ium-1-yl)-2-keto-ethyl]-[(1S)-2-keto-1-phenyl-2-pyrrolidino-ethyl]-methyl-ammonium Formula: C26H36N4O2+2 MolecularWeight: 436.58964

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Descriptors Computed from Structure

Canonical SMILES:

C[NH+](CC(=O)N1CC[NH+](CC1)CC2=CC=CC=C2)C(C3=CC=CC=C3)C(=O)N4CCCC4

Isomeric SMILES

C[NH+](CC(=O)N1CC[NH+](CC1)CC2=CC=CC=C2)[C@@H](C3=CC=CC=C3)C(=O)N4CCCC4

InChI

InChI=1S/C26H34N4O2/c1-27(25(23-12-6-3-7-13-23)26(32)30-14-8-9-15-30)21-24(31)29-18-16-28(17-19-29)20-22-10-4-2-5-11-22/h2-7,10-13,25H,8-9,14-21H2,1H3/p+2/t25-/m0/s1