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

Systemtic Name: 8-(2-methylpropyl)-4-phenethyl-2-(pyridin-3-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-isobutyl-4-phenethyl-2-(3-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-(2-methylpropyl)-4-phenethyl-2-(3-pyridinylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-(2-methylpropyl)-4-phenethyl-2-(pyridin-3-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 8-isobutyl-4-phenethyl-2-(3-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)C[NH+]1CCC2(CC1)C(=O)N(C(=O)N2CCC3=CC=CC=C3)CC4=CN=CC=C4

Isomeric SMILES

CC(C)C[NH+]1CCC2(CC1)C(=O)N(C(=O)N2CCC3=CC=CC=C3)CC4=CN=CC=C4

InChI

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