4-(3-methylbutyl)-2-propan-2-yl-8-(pyridin-2-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 4-(3-methylbutyl)-2-propan-2-yl-8-(pyridin-2-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 4-isopentyl-2-isopropyl-8-(2-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 4-(3-methylbutyl)-2-propan-2-yl-8-(2-pyridinylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 4-(3-methylbutyl)-2-propan-2-yl-8-(pyridin-2-ylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 4-isoamyl-2-isopropyl-8-(2-pyridylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C21H33N4O2+ MolecularWeight: 373.51232

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CCN1C(=O)N(C(=O)C12CC[NH+](CC2)CC3=CC=CC=N3)C(C)C

Isomeric SMILES

CC(C)CCN1C(=O)N(C(=O)C12CC[NH+](CC2)CC3=CC=CC=N3)C(C)C

InChI

InChI=1S/C21H32N4O2/c1-16(2)8-12-24-20(27)25(17(3)4)19(26)21(24)9-13-23(14-10-21)15-18-7-5-6-11-22-18/h5-7,11,16-17H,8-10,12-15H2,1-4H3/p+1