methyl 2-[4-(4-ethylpiperazin-1-yl)carbonylpiperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-(4-ethylpiperazin-1-yl)carbonylpiperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-(4-ethylpiperazine-1-carbonyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[(4-ethyl-1-piperazinyl)-oxomethyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(4-ethylpiperazine-1-carbonyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-(4-ethylpiperazine-1-carbonyl)piperidino]sulfonylbenzoic acid methyl ester Formula: C20H29N3O5S MolecularWeight: 423.52636

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Descriptors Computed from Structure

Canonical SMILES:

CCN1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

Isomeric SMILES

CCN1CCN(CC1)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC=CC=C3C(=O)OC

InChI

InChI=1S/C20H29N3O5S/c1-3-21-12-14-22(15-13-21)19(24)16-8-10-23(11-9-16)29(26,27)18-7-5-4-6-17(18)20(25)28-2/h4-7,16H,3,8-15H2,1-2H3