N-[3-[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]carbonylphenyl]ethanesulfonamide

Systemtic Name: N-[3-[4-[(4-ethoxyphenyl)methyl]piperazin-1-yl]carbonylphenyl]ethanesulfonamide Openeye Name: N-[3-[4-[(4-ethoxyphenyl)methyl]piperazine-1-carbonyl]phenyl]ethanesulfonamide CAS Name: N-[3-[[4-[(4-ethoxyphenyl)methyl]-1-piperazinyl]-oxomethyl]phenyl]ethanesulfonamide IUPAC Name: N-[3-[4-[(4-ethoxyphenyl)methyl]piperazine-1-carbonyl]phenyl]ethanesulfonamide Traditional Name: N-[3-[4-(4-ethoxybenzyl)piperazine-1-carbonyl]phenyl]ethanesulfonamide Formula: C22H29N3O4S MolecularWeight: 431.54836

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C22H29N3O4S/c1-3-29-21-10-8-18(9-11-21)17-24-12-14-25(15-13-24)22(26)19-6-5-7-20(16-19)23-30(27,28)4-2/h5-11,16,23H,3-4,12-15,17H2,1-2H3