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

Systemtic Name: benzotriazol-1-yl 4-[4-[4-(4-cyclohexyl-4-methoxy-cyclohexyl)piperazin-1-yl]phenyl]benzoate Openeye Name: benzotriazol-1-yl 4-[4-[4-(4-cyclohexyl-4-methoxy-cyclohexyl)piperazin-1-yl]phenyl]benzoate CAS Name: 4-[4-[4-(4-cyclohexyl-4-methoxycyclohexyl)-1-piperazinyl]phenyl]benzoic acid 1-benzotriazolyl ester IUPAC Name: benzotriazol-1-yl 4-[4-[4-(4-cyclohexyl-4-methoxycyclohexyl)piperazin-1-yl]phenyl]benzoate Traditional Name: 4-[4-[4-(4-cyclohexyl-4-methoxy-cyclohexyl)piperazino]phenyl]benzoic acid benzotriazol-1-yl ester Formula: C36H43N5O3 MolecularWeight: 593.75832

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Descriptors Computed from Structure

Canonical SMILES:

COC1(CCC(CC1)N2CCN(CC2)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)ON5C6=CC=CC=C6N=N5)C7CCCCC7

Isomeric SMILES

COC1(CCC(CC1)N2CCN(CC2)C3=CC=C(C=C3)C4=CC=C(C=C4)C(=O)ON5C6=CC=CC=C6N=N5)C7CCCCC7

InChI

InChI=1S/C36H43N5O3/c1-43-36(30-7-3-2-4-8-30)21-19-32(20-22-36)40-25-23-39(24-26-40)31-17-15-28(16-18-31)27-11-13-29(14-12-27)35(42)44-41-34-10-6-5-9-33(34)37-38-41/h5-6,9-18,30,32H,2-4,7-8,19-26H2,1H3