methyl 4-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]carbonylbenzoate

Systemtic Name: methyl 4-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazin-1-yl]carbonylbenzoate Openeye Name: methyl 4-(4-tetralin-6-ylsulfonylpiperazine-1-carbonyl)benzoate CAS Name: 4-[oxo-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)-1-piperazinyl]methyl]benzoic acid methyl ester IUPAC Name: methyl 4-[4-(5,6,7,8-tetrahydronaphthalen-2-ylsulfonyl)piperazine-1-carbonyl]benzoate Traditional Name: 4-(4-tetralin-6-ylsulfonylpiperazine-1-carbonyl)benzoic acid methyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

COC(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

Isomeric SMILES

COC(=O)C1=CC=C(C=C1)C(=O)N2CCN(CC2)S(=O)(=O)C3=CC4=C(CCCC4)C=C3

InChI

InChI=1S/C23H26N2O5S/c1-30-23(27)19-8-6-18(7-9-19)22(26)24-12-14-25(15-13-24)31(28,29)21-11-10-17-4-2-3-5-20(17)16-21/h6-11,16H,2-5,12-15H2,1H3