N-[(2S)-1-(azepan-1-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide

Systemtic Name: N-[(2S)-1-(azepan-1-yl)-3-methyl-1-oxidanylidene-butan-2-yl]-2-methyl-benzamide Openeye Name: N-[(1S)-1-(azepane-1-carbonyl)-2-methyl-propyl]-2-methyl-benzamide CAS Name: N-[(2S)-1-(1-azepanyl)-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide IUPAC Name: N-[(2S)-1-(azepan-1-yl)-3-methyl-1-oxobutan-2-yl]-2-methylbenzamide Traditional Name: N-[(1S)-1-(azepane-1-carbonyl)-2-methyl-propyl]-2-methyl-benzamide Formula: C19H28N2O2 MolecularWeight: 316.43782

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=CC=C1C(=O)NC(C(C)C)C(=O)N2CCCCCC2

Isomeric SMILES

CC1=CC=CC=C1C(=O)N[C@@H](C(C)C)C(=O)N2CCCCCC2

InChI

InChI=1S/C19H28N2O2/c1-14(2)17(19(23)21-12-8-4-5-9-13-21)20-18(22)16-11-7-6-10-15(16)3/h6-7,10-11,14,17H,4-5,8-9,12-13H2,1-3H3,(H,20,22)/t17-/m0/s1