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

Systemtic Name: 2-(2-methylpropyl)-4-phenethyl-8-(phenylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-benzyl-2-isobutyl-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 2-(2-methylpropyl)-4-phenethyl-8-(phenylmethyl)-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-benzyl-2-(2-methylpropyl)-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 8-benzyl-2-isobutyl-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C26H34N3O2+ MolecularWeight: 420.56706

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C26H33N3O2/c1-21(2)19-28-24(30)26(29(25(28)31)16-13-22-9-5-3-6-10-22)14-17-27(18-15-26)20-23-11-7-4-8-12-23/h3-12,21H,13-20H2,1-2H3/p+1