ethyl 4-[4-(2,3-dihydro-1H-inden-5-ylcarbonyl)piperazin-1-yl]sulfonylbenzoate

Systemtic Name: ethyl 4-[4-(2,3-dihydro-1H-inden-5-ylcarbonyl)piperazin-1-yl]sulfonylbenzoate Openeye Name: ethyl 4-[4-(indane-5-carbonyl)piperazin-1-yl]sulfonylbenzoate CAS Name: 4-[[4-[2,3-dihydro-1H-inden-5-yl(oxo)methyl]-1-piperazinyl]sulfonyl]benzoic acid ethyl ester IUPAC Name: ethyl 4-[4-(2,3-dihydro-1H-indene-5-carbonyl)piperazin-1-yl]sulfonylbenzoate Traditional Name: 4-[4-(indane-5-carbonyl)piperazino]sulfonylbenzoic acid ethyl ester Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(CCC4)C=C3

Isomeric SMILES

CCOC(=O)C1=CC=C(C=C1)S(=O)(=O)N2CCN(CC2)C(=O)C3=CC4=C(CCC4)C=C3

InChI

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