methyl 4-(4-piperidin-1-ylcarbonylpiperazin-1-yl)sulfonylbenzoate

Systemtic Name: methyl 4-(4-piperidin-1-ylcarbonylpiperazin-1-yl)sulfonylbenzoate Openeye Name: methyl 4-[4-(piperidine-1-carbonyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(piperidine-1-carbonyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(piperidine-1-carbonyl)piperazino]sulfonylbenzoic acid methyl ester Formula: C18H25N3O5S MolecularWeight: 395.4732

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCCC3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCCC3

InChI

InChI=1S/C18H25N3O5S/c1-26-17(22)15-5-7-16(8-6-15)27(24,25)21-13-11-20(12-14-21)18(23)19-9-3-2-4-10-19/h5-8H,2-4,9-14H2,1H3