4-(2-methylpropyl)-8-phenethyl-2-(3-pyridin-3-ylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 4-(2-methylpropyl)-8-phenethyl-2-(3-pyridin-3-ylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 4-isobutyl-8-phenethyl-2-[3-(3-pyridyl)propyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 4-(2-methylpropyl)-8-phenethyl-2-[3-(3-pyridinyl)propyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 4-(2-methylpropyl)-8-phenethyl-2-(3-pyridin-3-ylpropyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 4-isobutyl-8-phenethyl-2-[3-(3-pyridyl)propyl]-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C27H37N4O2+ MolecularWeight: 449.60828

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)N(C(=O)C12CC[NH+](CC2)CCC3=CC=CC=C3)CCCC4=CN=CC=C4

Isomeric SMILES

CC(C)CN1C(=O)N(C(=O)C12CC[NH+](CC2)CCC3=CC=CC=C3)CCCC4=CN=CC=C4

InChI

InChI=1S/C27H36N4O2/c1-22(2)21-31-26(33)30(16-7-11-24-10-6-15-28-20-24)25(32)27(31)13-18-29(19-14-27)17-12-23-8-4-3-5-9-23/h3-6,8-10,15,20,22H,7,11-14,16-19,21H2,1-2H3/p+1