5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-(2-morpholin-4-ylethyl)pyrrole-3-carboxamide

Systemtic Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-(2-morpholin-4-ylethyl)pyrrole-3-carboxamide Openeye Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-(2-morpholinoethyl)pyrrole-3-carboxamide CAS Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-[2-(4-morpholinyl)ethyl]-3-pyrrolecarboxamide IUPAC Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-(2-morpholin-4-ylethyl)pyrrole-3-carboxamide Traditional Name: 5-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-2-methyl-1-(2-morpholinoethyl)pyrrole-3-carboxamide Formula: C21H27N3O4 MolecularWeight: 385.45678

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCN2CCOCC2)C3=CC4=C(C=C3)OCCCO4)C(=O)N

Isomeric SMILES

CC1=C(C=C(N1CCN2CCOCC2)C3=CC4=C(C=C3)OCCCO4)C(=O)N

InChI

InChI=1S/C21H27N3O4/c1-15-17(21(22)25)14-18(24(15)6-5-23-7-11-26-12-8-23)16-3-4-19-20(13-16)28-10-2-9-27-19/h3-4,13-14H,2,5-12H2,1H3,(H2,22,25)