N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-methylsulfonyl-piperidine-4-carboxamide

Systemtic Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-methylsulfonyl-piperidine-4-carboxamide Openeye Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-methylsulfonyl-piperidine-4-carboxamide CAS Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-methylsulfonyl-4-piperidinecarboxamide IUPAC Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-methylsulfonylpiperidine-4-carboxamide Traditional Name: N-[1-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)ethyl]-1-mesyl-isonipecotamide Formula: C18H26N2O5S MolecularWeight: 382.47444

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3CCN(CC3)S(=O)(=O)C

Isomeric SMILES

CC(C1=CC2=C(C=C1)OCCCO2)NC(=O)C3CCN(CC3)S(=O)(=O)C

InChI

InChI=1S/C18H26N2O5S/c1-13(15-4-5-16-17(12-15)25-11-3-10-24-16)19-18(21)14-6-8-20(9-7-14)26(2,22)23/h4-5,12-14H,3,6-11H2,1-2H3,(H,19,21)