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

Systemtic Name: N-(3-chloranyl-4-methoxy-phenyl)-2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]ethanamide Openeye Name: N-(3-chloro-4-methoxy-phenyl)-2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]acetamide CAS Name: N-(3-chloro-4-methoxyphenyl)-2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]acetamide IUPAC Name: N-(3-chloro-4-methoxyphenyl)-2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]acetamide Traditional Name: N-(3-chloro-4-methoxy-phenyl)-2-[2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidino]acetamide Formula: C22H25ClN2O4 MolecularWeight: 416.8979

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)NC(=O)CN2CCCC2C3=CC4=C(C=C3)OCCCO4)Cl

Isomeric SMILES

COC1=C(C=C(C=C1)NC(=O)CN2CCCC2C3=CC4=C(C=C3)OCCCO4)Cl

InChI

InChI=1S/C22H25ClN2O4/c1-27-19-8-6-16(13-17(19)23)24-22(26)14-25-9-2-4-18(25)15-5-7-20-21(12-15)29-11-3-10-28-20/h5-8,12-13,18H,2-4,9-11,14H2,1H3,(H,24,26)