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

Systemtic Name: N-(2-butan-2-ylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide Openeye Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(2-sec-butylphenyl)propanamide CAS Name: N-(2-butan-2-ylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide IUPAC Name: N-(2-butan-2-ylphenyl)-2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)propanamide Traditional Name: 2-(3,4-dihydro-2H-1,5-benzodioxepin-7-ylamino)-N-(2-sec-butylphenyl)propionamide Formula: C22H28N2O3 MolecularWeight: 368.46932

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCC(C)C1=CC=CC=C1NC(=O)C(C)NC2=CC3=C(C=C2)OCCCO3

Isomeric SMILES

CCC(C)C1=CC=CC=C1NC(=O)C(C)NC2=CC3=C(C=C2)OCCCO3

InChI

InChI=1S/C22H28N2O3/c1-4-15(2)18-8-5-6-9-19(18)24-22(25)16(3)23-17-10-11-20-21(14-17)27-13-7-12-26-20/h5-6,8-11,14-16,23H,4,7,12-13H2,1-3H3,(H,24,25)