N-[4-(2-diethylaminoethylcarbamoyl)phenyl]-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxamide

Systemtic Name: N-[4-(2-diethylaminoethylcarbamoyl)phenyl]-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxamide Openeye Name: N-[4-(2-diethylaminoethylcarbamoyl)phenyl]-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxamide CAS Name: N-[4-[(2-diethylaminoethylamino)-oxomethyl]phenyl]-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)-4-piperidinecarboxamide IUPAC Name: N-[4-(2-diethylaminoethylcarbamoyl)phenyl]-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)piperidine-4-carboxamide Traditional Name: N-[4-(2-diethylaminoethylcarbamoyl)phenyl]-1-(2,3-dihydro-1,4-benzodioxin-6-ylsulfonyl)isonipecotamide Formula: C27H36N4O6S MolecularWeight: 544.66294

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Descriptors Computed from Structure

Canonical SMILES:

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

Isomeric SMILES

CCN(CC)CCNC(=O)C1=CC=C(C=C1)NC(=O)C2CCN(CC2)S(=O)(=O)C3=CC4=C(C=C3)OCCO4

InChI

InChI=1S/C27H36N4O6S/c1-3-30(4-2)16-13-28-26(32)20-5-7-22(8-6-20)29-27(33)21-11-14-31(15-12-21)38(34,35)23-9-10-24-25(19-23)37-18-17-36-24/h5-10,19,21H,3-4,11-18H2,1-2H3,(H,28,32)(H,29,33)