1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(4-dimethylaminophenyl)methyl]-N-methyl-piperidine-4-carboxamide

Systemtic Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(4-dimethylaminophenyl)methyl]-N-methyl-piperidine-4-carboxamide Openeye Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(4-dimethylaminophenyl)methyl]-N-methyl-piperidine-4-carboxamide CAS Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(4-dimethylaminophenyl)methyl]-N-methyl-4-piperidinecarboxamide IUPAC Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[(4-dimethylaminophenyl)methyl]-N-methylpiperidine-4-carboxamide Traditional Name: 1-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl)-N-[4-(dimethylamino)benzyl]-N-methyl-isonipecotamide Formula: C25H33N3O5S MolecularWeight: 487.61162

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)C1=CC=C(C=C1)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CN(C)C1=CC=C(C=C1)CN(C)C(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H33N3O5S/c1-26(2)21-7-5-19(6-8-21)18-27(3)25(29)20-11-13-28(14-12-20)34(30,31)22-9-10-23-24(17-22)33-16-4-15-32-23/h5-10,17,20H,4,11-16,18H2,1-3H3