(5S,8S)-9-phenethyl-8-(phenylmethyl)-5-propan-2-yl-3,9-diaza-6-azoniaspiro[5.5]undecan-10-one

Systemtic Name: (5S,8S)-9-phenethyl-8-(phenylmethyl)-5-propan-2-yl-3,9-diaza-6-azoniaspiro[5.5]undecan-10-one Openeye Name: (5S,8S)-8-benzyl-5-isopropyl-9-phenethyl-3,9-diaza-6-azoniaspiro[5.5]undecan-10-one CAS Name: (5S,8S)-9-phenethyl-8-(phenylmethyl)-5-propan-2-yl-3,9-diaza-6-azoniaspiro[5.5]undecan-10-one IUPAC Name: (5S,8S)-8-benzyl-9-phenethyl-5-propan-2-yl-3,9-diaza-6-azoniaspiro[5.5]undecan-10-one Traditional Name: (5S,8S)-8-benzyl-5-isopropyl-9-phenethyl-3,9-diaza-6-azoniaspiro[5.5]undecan-10-one Formula: C26H36N3O+ MolecularWeight: 406.58354

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1CNCC[N+]12CC(N(C(=O)C2)CCC3=CC=CC=C3)CC4=CC=CC=C4

Isomeric SMILES

CC(C)[C@H]1CNCC[N+]12C[C@@H](N(C(=O)C2)CCC3=CC=CC=C3)CC4=CC=CC=C4

InChI

InChI=1S/C26H36N3O/c1-21(2)25-18-27-14-16-29(25)19-24(17-23-11-7-4-8-12-23)28(26(30)20-29)15-13-22-9-5-3-6-10-22/h3-12,21,24-25,27H,13-20H2,1-2H3/q+1/t24-,25+,29?/m0/s1