2-methyl-N-[[4-(3-methylbutanoyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(4-methylphenyl)propanamide

Systemtic Name: 2-methyl-N-[[4-(3-methylbutanoyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(4-methylphenyl)propanamide Openeye Name: 2-methyl-N-[[4-(3-methylbutanoyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(p-tolyl)propanamide CAS Name: 2-methyl-N-[[4-(3-methyl-1-oxobutyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(4-methylphenyl)propanamide IUPAC Name: 2-methyl-N-[[4-(3-methylbutanoyl)-3,5-dihydro-2H-1,4-benzoxazepin-7-yl]methyl]-N-(4-methylphenyl)propanamide Traditional Name: N-[(4-isovaleryl-3,5-dihydro-2H-1,4-benzoxazepin-7-yl)methyl]-2-methyl-N-(p-tolyl)propionamide Formula: C26H34N2O3 MolecularWeight: 422.55976

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)N(CC2=CC3=C(C=C2)OCCN(C3)C(=O)CC(C)C)C(=O)C(C)C

Isomeric SMILES

CC1=CC=C(C=C1)N(CC2=CC3=C(C=C2)OCCN(C3)C(=O)CC(C)C)C(=O)C(C)C

InChI

InChI=1S/C26H34N2O3/c1-18(2)14-25(29)27-12-13-31-24-11-8-21(15-22(24)17-27)16-28(26(30)19(3)4)23-9-6-20(5)7-10-23/h6-11,15,18-19H,12-14,16-17H2,1-5H3