N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide

Systemtic Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Openeye Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[4-(1-piperidylsulfonyl)phenyl]propanamide CAS Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-[4-(1-piperidinylsulfonyl)phenyl]propanamide IUPAC Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-piperidin-1-ylsulfonylphenyl)propanamide Traditional Name: N-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-3-(4-piperidinosulfonylphenyl)propionamide Formula: C23H28N2O5S MolecularWeight: 444.54382

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CCN(CC1)S(=O)(=O)C2=CC=C(C=C2)CCC(=O)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C23H28N2O5S/c26-23(24-19-8-11-21-22(17-19)30-16-4-15-29-21)12-7-18-5-9-20(10-6-18)31(27,28)25-13-2-1-3-14-25/h5-6,8-11,17H,1-4,7,12-16H2,(H,24,26)