methyl 2-[cyclohexylcarbonyl-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]amino]benzoate

Systemtic Name: methyl 2-[cyclohexylcarbonyl-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]amino]benzoate Openeye Name: methyl 2-[cyclohexanecarbonyl-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]amino]benzoate CAS Name: 2-[[cyclohexyl(oxo)methyl]-[2-[4-(2-methoxyphenyl)-1-piperazinyl]ethyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-[cyclohexanecarbonyl-[2-[4-(2-methoxyphenyl)piperazin-1-yl]ethyl]amino]benzoate Traditional Name: 2-[cyclohexanecarbonyl-[2-[4-(2-methoxyphenyl)piperazino]ethyl]amino]benzoic acid methyl ester Formula: C28H37N3O4 MolecularWeight: 479.61108

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC=C1N2CCN(CC2)CCN(C3=CC=CC=C3C(=O)OC)C(=O)C4CCCCC4

Isomeric SMILES

COC1=CC=CC=C1N2CCN(CC2)CCN(C3=CC=CC=C3C(=O)OC)C(=O)C4CCCCC4

InChI

InChI=1S/C28H37N3O4/c1-34-26-15-9-8-14-25(26)30-19-16-29(17-20-30)18-21-31(27(32)22-10-4-3-5-11-22)24-13-7-6-12-23(24)28(33)35-2/h6-9,12-15,22H,3-5,10-11,16-21H2,1-2H3