N-[2-(2-chlorophenyl)-2-morpholin-4-yl-ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide

Systemtic Name: N-[2-(2-chlorophenyl)-2-morpholin-4-yl-ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Openeye Name: N-[2-(2-chlorophenyl)-2-morpholino-ethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide CAS Name: N-[2-(2-chlorophenyl)-2-(4-morpholinyl)ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide IUPAC Name: N-[2-(2-chlorophenyl)-2-morpholin-4-ylethyl]-3,4-dihydro-2H-1,5-benzodioxepine-7-carboxamide Traditional Name: N-[2-(2-chlorophenyl)-2-morpholino-ethyl]-3,4-dihydro-2H-1,5-benzodioxepin-7-carboxamide Formula: C22H25ClN2O4 MolecularWeight: 416.8979

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Descriptors Computed from Structure

Canonical SMILES:

C1COC2=C(C=C(C=C2)C(=O)NCC(C3=CC=CC=C3Cl)N4CCOCC4)OC1

Isomeric SMILES

C1COC2=C(C=C(C=C2)C(=O)NCC(C3=CC=CC=C3Cl)N4CCOCC4)OC1

InChI

InChI=1S/C22H25ClN2O4/c23-18-5-2-1-4-17(18)19(25-8-12-27-13-9-25)15-24-22(26)16-6-7-20-21(14-16)29-11-3-10-28-20/h1-2,4-7,14,19H,3,8-13,15H2,(H,24,26)