N-[5-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]carbonyl-2-methyl-phenyl]furan-2-carboxamide

Systemtic Name: N-[5-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidin-1-yl]carbonyl-2-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[5-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carbonyl]-2-methyl-phenyl]furan-2-carboxamide CAS Name: N-[5-[[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)-1-pyrrolidinyl]-oxomethyl]-2-methylphenyl]-2-furancarboxamide IUPAC Name: N-[5-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carbonyl]-2-methylphenyl]furan-2-carboxamide Traditional Name: N-[5-[(2S)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-yl)pyrrolidine-1-carbonyl]-2-methyl-phenyl]-2-furamide Formula: C26H26N2O5 MolecularWeight: 446.49504

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)N2CCCC2C3=CC4=C(C=C3)OCCCO4)NC(=O)C5=CC=CO5

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)N2CCC[C@H]2C3=CC4=C(C=C3)OCCCO4)NC(=O)C5=CC=CO5

InChI

InChI=1S/C26H26N2O5/c1-17-7-8-19(15-20(17)27-25(29)23-6-3-12-32-23)26(30)28-11-2-5-21(28)18-9-10-22-24(16-18)33-14-4-13-31-22/h3,6-10,12,15-16,21H,2,4-5,11,13-14H2,1H3,(H,27,29)/t21-/m0/s1