ethyl 3-bromanyl-4-(4-piperidin-1-ylcarbonylpiperazin-1-yl)sulfonyl-benzoate

Systemtic Name: ethyl 3-bromanyl-4-(4-piperidin-1-ylcarbonylpiperazin-1-yl)sulfonyl-benzoate Openeye Name: ethyl 3-bromo-4-[4-(piperidine-1-carbonyl)piperazin-1-yl]sulfonyl-benzoate CAS Name: 3-bromo-4-[[4-[oxo(1-piperidinyl)methyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 3-bromo-4-[4-(piperidine-1-carbonyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 3-bromo-4-[4-(piperidine-1-carbonyl)piperazino]sulfonyl-benzoic acid ethyl ester Formula: C19H26BrN3O5S MolecularWeight: 488.39584

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCCC3)Br

Isomeric SMILES

CCOC(=O)C1=CC(=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)N3CCCCC3)Br

InChI

InChI=1S/C19H26BrN3O5S/c1-2-28-18(24)15-6-7-17(16(20)14-15)29(26,27)23-12-10-22(11-13-23)19(25)21-8-4-3-5-9-21/h6-7,14H,2-5,8-13H2,1H3