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

Systemtic Name: N-[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-methyl-phenyl]furan-2-carboxamide Openeye Name: N-[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-methyl-phenyl]furan-2-carboxamide CAS Name: N-[5-[(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-oxomethyl]-2-methylphenyl]-2-furancarboxamide IUPAC Name: N-[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-methylphenyl]furan-2-carboxamide Traditional Name: N-[5-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylcarbamoyl)-2-methyl-phenyl]-2-furamide Formula: C22H20N2O5 MolecularWeight: 392.4046

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3)NC(=O)C4=CC=CO4

Isomeric SMILES

CC1=C(C=C(C=C1)C(=O)NC2=CC3=C(C=C2)OCCCO3)NC(=O)C4=CC=CO4

InChI

InChI=1S/C22H20N2O5/c1-14-5-6-15(12-17(14)24-22(26)19-4-2-9-28-19)21(25)23-16-7-8-18-20(13-16)29-11-3-10-27-18/h2,4-9,12-13H,3,10-11H2,1H3,(H,23,25)(H,24,26)