4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoic acid

Systemtic Name: 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoic acid Openeye Name: 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoic acid CAS Name: 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]-1-piperazinyl]phenyl]benzoic acid IUPAC Name: 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazin-1-yl]phenyl]benzoic acid Traditional Name: 4-[4-[4-[4-(4-methoxyphenyl)cyclohexyl]piperazino]phenyl]benzoic acid Formula: C30H34N2O3 MolecularWeight: 470.60256

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C30H34N2O3/c1-35-29-16-10-25(11-17-29)24-8-14-28(15-9-24)32-20-18-31(19-21-32)27-12-6-23(7-13-27)22-2-4-26(5-3-22)30(33)34/h2-7,10-13,16-17,24,28H,8-9,14-15,18-21H2,1H3,(H,33,34)