N-(2-benzamidoethyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide

Systemtic Name: N-(2-benzamidoethyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Openeye Name: N-(2-benzamidoethyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide CAS Name: N-(2-benzamidoethyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide IUPAC Name: N-(2-benzamidoethyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Traditional Name: N-(2-benzamidoethyl)-3-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonylamino)benzamide Formula: C25H25N3O6S MolecularWeight: 495.5475

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)NCCNC(=O)C4=CC=CC=C4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)S(=O)(=O)NC3=CC=CC(=C3)C(=O)NCCNC(=O)C4=CC=CC=C4)OC1

InChI

InChI=1S/C25H25N3O6S/c29-24(18-6-2-1-3-7-18)26-12-13-27-25(30)19-8-4-9-20(16-19)28-35(31,32)21-10-11-22-23(17-21)34-15-5-14-33-22/h1-4,6-11,16-17,28H,5,12-15H2,(H,26,29)(H,27,30)