8-[(2,3-dimethoxyphenyl)methyl]-2-ethyl-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione

Systemtic Name: 8-[(2,3-dimethoxyphenyl)methyl]-2-ethyl-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Openeye Name: 8-[(2,3-dimethoxyphenyl)methyl]-2-ethyl-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione CAS Name: 8-[(2,3-dimethoxyphenyl)methyl]-2-ethyl-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione IUPAC Name: 8-[(2,3-dimethoxyphenyl)methyl]-2-ethyl-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-dione Traditional Name: 2-ethyl-8-o-veratryl-4-phenethyl-2,4-diaza-8-azoniaspiro[4.5]decane-1,3-quinone Formula: C26H34N3O4+ MolecularWeight: 452.56586

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCN1C(=O)C2(CC[NH+](CC2)CC3=C(C(=CC=C3)OC)OC)N(C1=O)CCC4=CC=CC=C4

Isomeric SMILES

CCN1C(=O)C2(CC[NH+](CC2)CC3=C(C(=CC=C3)OC)OC)N(C1=O)CCC4=CC=CC=C4

InChI

InChI=1S/C26H33N3O4/c1-4-28-24(30)26(29(25(28)31)16-13-20-9-6-5-7-10-20)14-17-27(18-15-26)19-21-11-8-12-22(32-2)23(21)33-3/h5-12H,4,13-19H2,1-3H3/p+1