N-[4-[4-(phenylmethyl)piperidin-1-yl]sulfonylphenyl]-2,3-dihydro-1,4-dioxine-5-carboxamide

Systemtic Name: N-[4-[4-(phenylmethyl)piperidin-1-yl]sulfonylphenyl]-2,3-dihydro-1,4-dioxine-5-carboxamide Openeye Name: N-[4-[(4-benzyl-1-piperidyl)sulfonyl]phenyl]-2,3-dihydro-1,4-dioxine-5-carboxamide CAS Name: N-[4-[[4-(phenylmethyl)-1-piperidinyl]sulfonyl]phenyl]-2,3-dihydro-1,4-dioxin-5-carboxamide IUPAC Name: N-[4-(4-benzylpiperidin-1-yl)sulfonylphenyl]-2,3-dihydro-1,4-dioxine-5-carboxamide Traditional Name: N-[4-(4-benzylpiperidino)sulfonylphenyl]-2,3-dihydro-p-dioxin-5-carboxamide Formula: C23H26N2O5S MolecularWeight: 442.52794

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=COCCO4

Isomeric SMILES

C1CN(CCC1CC2=CC=CC=C2)S(=O)(=O)C3=CC=C(C=C3)NC(=O)C4=COCCO4

InChI

InChI=1S/C23H26N2O5S/c26-23(22-17-29-14-15-30-22)24-20-6-8-21(9-7-20)31(27,28)25-12-10-19(11-13-25)16-18-4-2-1-3-5-18/h1-9,17,19H,10-16H2,(H,24,26)