2-azaniumylethyl-cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]azanium

Systemtic Name: 2-azaniumylethyl-cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]azanium Openeye Name: 2-azaniumylethyl-cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]ammonium CAS Name: 2-ammonioethyl-cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]ammonium IUPAC Name: 2-azaniumylethyl-cyclopentyl-[(3,4,5-trimethoxyphenyl)methyl]azanium Traditional Name: 2-ammonioethyl-cyclopentyl-(3,4,5-trimethoxybenzyl)ammonium Formula: C17H30N2O3+2 MolecularWeight: 310.4317

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=CC(=C1OC)OC)C[NH+](CC[NH3+])C2CCCC2

Isomeric SMILES

COC1=CC(=CC(=C1OC)OC)C[NH+](CC[NH3+])C2CCCC2

InChI

InChI=1S/C17H28N2O3/c1-20-15-10-13(11-16(21-2)17(15)22-3)12-19(9-8-18)14-6-4-5-7-14/h10-11,14H,4-9,12,18H2,1-3H3/p+2