1-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-1,2,3,4-tetrazol-5-yl]methyl]-4-(2-methoxyphenyl)piperazine

Systemtic Name: 1-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-1,2,3,4-tetrazol-5-yl]methyl]-4-(2-methoxyphenyl)piperazine Openeye Name: 1-[[1-[2-(3,4-dimethoxyphenyl)ethyl]tetrazol-5-yl]methyl]-4-(2-methoxyphenyl)piperazine CAS Name: 1-[[1-[2-(3,4-dimethoxyphenyl)ethyl]-5-tetrazolyl]methyl]-4-(2-methoxyphenyl)piperazine IUPAC Name: 1-[[1-[2-(3,4-dimethoxyphenyl)ethyl]tetrazol-5-yl]methyl]-4-(2-methoxyphenyl)piperazine Traditional Name: 1-[(1-homoveratryltetrazol-5-yl)methyl]-4-(2-methoxyphenyl)piperazine Formula: C23H30N6O3 MolecularWeight: 438.5227

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)CCN2C(=NN=N2)CN3CCN(CC3)C4=CC=CC=C4OC)OC

Isomeric SMILES

COC1=C(C=C(C=C1)CCN2C(=NN=N2)CN3CCN(CC3)C4=CC=CC=C4OC)OC

InChI

InChI=1S/C23H30N6O3/c1-30-20-7-5-4-6-19(20)28-14-12-27(13-15-28)17-23-24-25-26-29(23)11-10-18-8-9-21(31-2)22(16-18)32-3/h4-9,16H,10-15,17H2,1-3H3