1-[2-[2-(4-methoxy-2-prop-2-enyl-phenoxy)ethoxy]ethyl]-4-(phenylmethyl)piperazine-1,4-diium

Systemtic Name: 1-[2-[2-(4-methoxy-2-prop-2-enyl-phenoxy)ethoxy]ethyl]-4-(phenylmethyl)piperazine-1,4-diium Openeye Name: 1-[2-[2-(2-allyl-4-methoxy-phenoxy)ethoxy]ethyl]-4-benzyl-piperazine-1,4-diium CAS Name: 1-[2-[2-(4-methoxy-2-prop-2-enylphenoxy)ethoxy]ethyl]-4-(phenylmethyl)piperazine-1,4-diium IUPAC Name: 1-benzyl-4-[2-[2-(4-methoxy-2-prop-2-enylphenoxy)ethoxy]ethyl]piperazine-1,4-diium Traditional Name: 1-[2-[2-(2-allyl-4-methoxy-phenoxy)ethoxy]ethyl]-4-benzyl-piperazine-1,4-diium Formula: C25H36N2O3+2 MolecularWeight: 412.56494

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OCCOCC[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)CC=C

Isomeric SMILES

COC1=CC(=C(C=C1)OCCOCC[NH+]2CC[NH+](CC2)CC3=CC=CC=C3)CC=C

InChI

InChI=1S/C25H34N2O3/c1-3-7-23-20-24(28-2)10-11-25(23)30-19-18-29-17-16-26-12-14-27(15-13-26)21-22-8-5-4-6-9-22/h3-6,8-11,20H,1,7,12-19,21H2,2H3/p+2