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

Systemtic Name: 1-[(2,5-dimethoxyphenyl)-(1-phenethyl-1,2,3,4-tetrazol-5-yl)methyl]-4-(phenylmethyl)piperazine Openeye Name: 1-benzyl-4-[(2,5-dimethoxyphenyl)-(1-phenethyltetrazol-5-yl)methyl]piperazine CAS Name: 1-[(2,5-dimethoxyphenyl)-(1-phenethyl-5-tetrazolyl)methyl]-4-(phenylmethyl)piperazine IUPAC Name: 1-benzyl-4-[(2,5-dimethoxyphenyl)-(1-phenethyltetrazol-5-yl)methyl]piperazine Traditional Name: 1-benzyl-4-[(2,5-dimethoxyphenyl)-(1-phenethyltetrazol-5-yl)methyl]piperazine Formula: C29H34N6O2 MolecularWeight: 498.61926

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)C(C2=NN=NN2CCC3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=C5

Isomeric SMILES

COC1=CC(=C(C=C1)OC)C(C2=NN=NN2CCC3=CC=CC=C3)N4CCN(CC4)CC5=CC=CC=C5

InChI

InChI=1S/C29H34N6O2/c1-36-25-13-14-27(37-2)26(21-25)28(29-30-31-32-35(29)16-15-23-9-5-3-6-10-23)34-19-17-33(18-20-34)22-24-11-7-4-8-12-24/h3-14,21,28H,15-20,22H2,1-2H3