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

Systemtic Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(4-phenylmethoxyphenyl)propanamide Openeye Name: N-(4-benzyloxyphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide CAS Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(4-phenylmethoxyphenyl)propanamide IUPAC Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(4-phenylmethoxyphenyl)propanamide Traditional Name: N-(4-benzoxyphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propionamide Formula: C25H26N2O4 MolecularWeight: 418.48494

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)NC3=CC4=C(C=C3)OCCCO4

Isomeric SMILES

CC(C(=O)NC1=CC=C(C=C1)OCC2=CC=CC=C2)NC3=CC4=C(C=C3)OCCCO4

InChI

InChI=1S/C25H26N2O4/c1-18(26-21-10-13-23-24(16-21)30-15-5-14-29-23)25(28)27-20-8-11-22(12-9-20)31-17-19-6-3-2-4-7-19/h2-4,6-13,16,18,26H,5,14-15,17H2,1H3,(H,27,28)