methyl 2-[4-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate

Systemtic Name: methyl 2-[4-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Openeye Name: methyl 2-[[4-(tetralin-1-ylcarbamoyl)-1-piperidyl]sulfonyl]benzoate CAS Name: 2-[[4-[oxo-(1,2,3,4-tetrahydronaphthalen-1-ylamino)methyl]-1-piperidinyl]sulfonyl]benzoic acid methyl ester IUPAC Name: methyl 2-[4-(1,2,3,4-tetrahydronaphthalen-1-ylcarbamoyl)piperidin-1-yl]sulfonylbenzoate Traditional Name: 2-[4-(tetralin-1-ylcarbamoyl)piperidino]sulfonylbenzoic acid methyl ester Formula: C24H28N2O5S MolecularWeight: 456.55452

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3CCCC4=CC=CC=C34

Isomeric SMILES

COC(=O)C1=CC=CC=C1S(=O)(=O)N2CCC(CC2)C(=O)NC3CCCC4=CC=CC=C34

InChI

InChI=1S/C24H28N2O5S/c1-31-24(28)20-10-4-5-12-22(20)32(29,30)26-15-13-18(14-16-26)23(27)25-21-11-6-8-17-7-2-3-9-19(17)21/h2-5,7,9-10,12,18,21H,6,8,11,13-16H2,1H3,(H,25,27)