1-(2-phenoxyethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium

Systemtic Name: 1-(2-phenoxyethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium Openeye Name: 1-(2-phenoxyethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium CAS Name: 1-(2-phenoxyethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium IUPAC Name: 1-(2-phenoxyethyl)-4-[(2,3,4-trimethoxyphenyl)methyl]piperazine-1,4-diium Traditional Name: 1-(2-phenoxyethyl)-4-(2,3,4-trimethoxybenzyl)piperazine-1,4-diium Formula: C22H32N2O4+2 MolecularWeight: 388.50048

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C(=C(C=C1)C[NH+]2CC[NH+](CC2)CCOC3=CC=CC=C3)OC)OC

Isomeric SMILES

COC1=C(C(=C(C=C1)C[NH+]2CC[NH+](CC2)CCOC3=CC=CC=C3)OC)OC

InChI

InChI=1S/C22H30N2O4/c1-25-20-10-9-18(21(26-2)22(20)27-3)17-24-13-11-23(12-14-24)15-16-28-19-7-5-4-6-8-19/h4-10H,11-17H2,1-3H3/p+2