[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]-(2-methylsulfonylphenyl)methanone

Systemtic Name: [4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]-(2-methylsulfonylphenyl)methanone Openeye Name: [4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]-(2-methylsulfonylphenyl)methanone CAS Name: [4-[(4-ethoxyphenyl)methyl]-1-piperazinyl]-(2-methylsulfonylphenyl)methanone IUPAC Name: [4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]-(2-methylsulfonylphenyl)methanone Traditional Name: [4-(4-ethoxybenzyl)piperazino]-(2-mesylphenyl)methanone Formula: C21H26N2O4S MolecularWeight: 402.50714

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC=C3S(=O)(=O)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CN2CCN(CC2)C(=O)C3=CC=CC=C3S(=O)(=O)C

InChI

InChI=1S/C21H26N2O4S/c1-3-27-18-10-8-17(9-11-18)16-22-12-14-23(15-13-22)21(24)19-6-4-5-7-20(19)28(2,25)26/h4-11H,3,12-16H2,1-2H3