2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(4-ethanoylphenyl)propanamide

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(4-ethanoylphenyl)propanamide Openeye Name: N-(4-acetylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide CAS Name: N-(4-acetylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide IUPAC Name: N-(4-acetylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide Traditional Name: N-(4-acetylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propionamide Formula: C20H22N2O4 MolecularWeight: 354.39968

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)C(=O)C)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)C(=O)C)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C20H22N2O4/c1-13(20(24)22-16-6-4-15(5-7-16)14(2)23)21-17-8-9-18-19(12-17)26-11-3-10-25-18/h4-9,12-13,21H,3,10-11H2,1-2H3,(H,22,24)