(5S,8S)-8-methyl-10-oxidanylidene-9-phenethyl-N-phenyl-5-propan-2-yl-3,9-diaza-6-azoniaspiro[5.5]undecane-3-carboxamide

Systemtic Name: (5S,8S)-8-methyl-10-oxidanylidene-9-phenethyl-N-phenyl-5-propan-2-yl-3,9-diaza-6-azoniaspiro[5.5]undecane-3-carboxamide Openeye Name: (5S,8S)-5-isopropyl-8-methyl-10-oxo-9-phenethyl-N-phenyl-3,9-diaza-6-azoniaspiro[5.5]undecane-3-carboxamide CAS Name: (5S,8S)-8-methyl-10-oxo-9-phenethyl-N-phenyl-5-propan-2-yl-3,9-diaza-6-azoniaspiro[5.5]undecane-3-carboxamide IUPAC Name: (5S,8S)-8-methyl-10-oxo-9-phenethyl-N-phenyl-5-propan-2-yl-3,9-diaza-6-azoniaspiro[5.5]undecane-3-carboxamide Traditional Name: (5S,8S)-5-isopropyl-10-keto-8-methyl-9-phenethyl-N-phenyl-3,9-diaza-6-azoniaspiro[5.5]undecane-3-carboxamide Formula: C27H37N4O2+ MolecularWeight: 449.60828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1C[N+]2(CCN(CC2C(C)C)C(=O)NC3=CC=CC=C3)CC(=O)N1CCC4=CC=CC=C4

Isomeric SMILES

C[C@H]1C[N+]2(CCN(C[C@@H]2C(C)C)C(=O)NC3=CC=CC=C3)CC(=O)N1CCC4=CC=CC=C4

InChI

InChI=1S/C27H36N4O2/c1-21(2)25-18-29(27(33)28-24-12-8-5-9-13-24)16-17-31(25)19-22(3)30(26(32)20-31)15-14-23-10-6-4-7-11-23/h4-13,21-22,25H,14-20H2,1-3H3/p+1/t22-,25+,31?/m0/s1