2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-N-(2-oxidanylideneazepan-3-yl)ethanamide

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-N-(2-oxidanylideneazepan-3-yl)ethanamide Openeye Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-N-(2-oxoazepan-3-yl)acetamide CAS Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-N-(2-oxo-3-azepanyl)acetamide IUPAC Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-N-(2-oxoazepan-3-yl)acetamide Traditional Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-N-(2-ketoazepan-3-yl)acetamide Formula: C21H29N3O4 MolecularWeight: 387.47266

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Descriptors Computed from Structure

Canonical SMILES:

C1CCNC(=O)C(C1)NC(=O)CN2CCCC2C3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

C1CCNC(=O)C(C1)NC(=O)CN2CCCC2C3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C21H29N3O4/c25-20(23-16-5-1-2-9-22-21(16)26)14-24-10-3-6-17(24)15-7-8-18-19(13-15)28-12-4-11-27-18/h7-8,13,16-17H,1-6,9-12,14H2,(H,22,26)(H,23,25)