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

Systemtic Name: 2-(2-methylpropyl)-4-phenethyl-8-(pyridin-4-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 2-isobutyl-4-phenethyl-8-(4-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 2-(2-methylpropyl)-4-phenethyl-8-(pyridin-4-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 2-(2-methylpropyl)-4-phenethyl-8-(pyridin-4-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 2-isobutyl-4-phenethyl-8-(4-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C25H33N4O2+ MolecularWeight: 421.55512

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CN1C(=O)C2(CC[NH+](CC2)CC3=CC=NC=C3)N(C1=O)CCC4=CC=CC=C4

Isomeric SMILES

CC(C)CN1C(=O)C2(CC[NH+](CC2)CC3=CC=NC=C3)N(C1=O)CCC4=CC=CC=C4

InChI

InChI=1S/C25H32N4O2/c1-20(2)18-28-23(30)25(29(24(28)31)15-10-21-6-4-3-5-7-21)11-16-27(17-12-25)19-22-8-13-26-14-9-22/h3-9,13-14,20H,10-12,15-19H2,1-2H3/p+1