benzotriazol-1-yl 4-[4-[4-(4-cyclohexylphenyl)piperazin-1-yl]piperidin-1-yl]benzoate

Systemtic Name: benzotriazol-1-yl 4-[4-[4-(4-cyclohexylphenyl)piperazin-1-yl]piperidin-1-yl]benzoate Openeye Name: benzotriazol-1-yl 4-[4-[4-(4-cyclohexylphenyl)piperazin-1-yl]-1-piperidyl]benzoate CAS Name: 4-[4-[4-(4-cyclohexylphenyl)-1-piperazinyl]-1-piperidinyl]benzoic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 4-[4-[4-(4-cyclohexylphenyl)piperazin-1-yl]piperidin-1-yl]benzoate Traditional Name: 4-[4-[4-(4-cyclohexylphenyl)piperazino]piperidino]benzoic acid benzotriazol-1-yl ester Formula: C34H40N6O2 MolecularWeight: 564.7204

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Descriptors Computed from Structure

Canonical SMILES:

C1CCC(CC1)C2=CC=C(C=C2)N3CCN(CC3)C4CCN(CC4)C5=CC=C(C=C5)C(=O)ON6C7=CC=CC=C7N=N6

Isomeric SMILES

C1CCC(CC1)C2=CC=C(C=C2)N3CCN(CC3)C4CCN(CC4)C5=CC=C(C=C5)C(=O)ON6C7=CC=CC=C7N=N6

InChI

InChI=1S/C34H40N6O2/c41-34(42-40-33-9-5-4-8-32(33)35-36-40)28-12-16-29(17-13-28)37-20-18-31(19-21-37)39-24-22-38(23-25-39)30-14-10-27(11-15-30)26-6-2-1-3-7-26/h4-5,8-17,26,31H,1-3,6-7,18-25H2