benzotriazol-1-yl 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoate

Systemtic Name: benzotriazol-1-yl 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoate Openeye Name: benzotriazol-1-yl 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoate CAS Name: 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]-1-piperazinyl]phenyl]benzoic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoate Traditional Name: 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazino]phenyl]benzoic acid benzotriazol-1-yl ester Formula: C36H37N5O3 MolecularWeight: 587.71068

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2CCC(CC2)N3CCN(CC3)C4=CC=C(C=C4)C5=CC=C(C=C5)C(=O)ON6C7=CC=CC=C7N=N6

Isomeric SMILES

COC1=CC=C(C=C1)C2CCC(CC2)N3CCN(CC3)C4=CC=C(C=C4)C5=CC=C(C=C5)C(=O)ON6C7=CC=CC=C7N=N6

InChI

InChI=1S/C36H37N5O3/c1-43-33-20-14-29(15-21-33)28-12-18-32(19-13-28)40-24-22-39(23-25-40)31-16-10-27(11-17-31)26-6-8-30(9-7-26)36(42)44-41-35-5-3-2-4-34(35)37-38-41/h2-11,14-17,20-21,28,32H,12-13,18-19,22-25H2,1H3