2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-N-(2,3-dimethyl-6-nitro-phenyl)ethanamide

Systemtic Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-N-(2,3-dimethyl-6-nitro-phenyl)ethanamide Openeye Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-N-(2,3-dimethyl-6-nitro-phenyl)acetamide CAS Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-N-(2,3-dimethyl-6-nitrophenyl)acetamide IUPAC Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]-N-(2,3-dimethyl-6-nitrophenyl)acetamide Traditional Name: 2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]-N-(2,3-dimethyl-6-nitro-phenyl)acetamide Formula: C23H27N3O5 MolecularWeight: 425.47758

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCCC2C3=CC4=C(C=C3)OCCCO4)C

Isomeric SMILES

CC1=C(C(=C(C=C1)[N+](=O)[O-])NC(=O)CN2CCCC2C3=CC4=C(C=C3)OCCCO4)C

InChI

InChI=1S/C23H27N3O5/c1-15-6-8-19(26(28)29)23(16(15)2)24-22(27)14-25-10-3-5-18(25)17-7-9-20-21(13-17)31-12-4-11-30-20/h6-9,13,18H,3-5,10-12,14H2,1-2H3,(H,24,27)