1-[3-(2-methoxy-4-prop-2-enyl-phenoxy)propyl]-4-(phenylmethyl)piperazine-1,4-diium

Systemtic Name: 1-[3-(2-methoxy-4-prop-2-enyl-phenoxy)propyl]-4-(phenylmethyl)piperazine-1,4-diium Openeye Name: 1-[3-(4-allyl-2-methoxy-phenoxy)propyl]-4-benzyl-piperazine-1,4-diium CAS Name: 1-[3-(2-methoxy-4-prop-2-enylphenoxy)propyl]-4-(phenylmethyl)piperazine-1,4-diium IUPAC Name: 1-benzyl-4-[3-(2-methoxy-4-prop-2-enylphenoxy)propyl]piperazine-1,4-diium Traditional Name: 1-[3-(4-allyl-2-methoxy-phenoxy)propyl]-4-benzyl-piperazine-1,4-diium Formula: C24H34N2O2+2 MolecularWeight: 382.53896

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H32N2O2/c1-3-8-21-11-12-23(24(19-21)27-2)28-18-7-13-25-14-16-26(17-15-25)20-22-9-5-4-6-10-22/h3-6,9-12,19H,1,7-8,13-18,20H2,2H3/p+2