3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[1-(phenylmethyl)piperidin-4-yl]propanamide

Systemtic Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[1-(phenylmethyl)piperidin-4-yl]propanamide Openeye Name: N-(1-benzyl-4-piperidyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanamide CAS Name: 3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-N-[1-(phenylmethyl)-4-piperidinyl]propanamide IUPAC Name: N-(1-benzylpiperidin-4-yl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propanamide Traditional Name: N-(1-benzyl-4-piperidyl)-3-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)propionamide Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3)CC4=CC=CC=C4

Isomeric SMILES

C1CN(CCC1NC(=O)CCS(=O)(=O)C2=CC3=C(C=C2)OCCO3)CC4=CC=CC=C4

InChI

InChI=1S/C23H28N2O5S/c26-23(24-19-8-11-25(12-9-19)17-18-4-2-1-3-5-18)10-15-31(27,28)20-6-7-21-22(16-20)30-14-13-29-21/h1-7,16,19H,8-15,17H2,(H,24,26)