N-[(1S)-1-(1,3-benzoxazol-2-yl)-3-methyl-butyl]-4-(3-methylphenoxy)butanamide

Systemtic Name: N-[(1S)-1-(1,3-benzoxazol-2-yl)-3-methyl-butyl]-4-(3-methylphenoxy)butanamide Openeye Name: N-[(1S)-1-(1,3-benzoxazol-2-yl)-3-methyl-butyl]-4-(3-methylphenoxy)butanamide CAS Name: N-[(1S)-1-(1,3-benzoxazol-2-yl)-3-methylbutyl]-4-(3-methylphenoxy)butanamide IUPAC Name: N-[(1S)-1-(1,3-benzoxazol-2-yl)-3-methylbutyl]-4-(3-methylphenoxy)butanamide Traditional Name: N-[(1S)-1-(1,3-benzoxazol-2-yl)-3-methyl-butyl]-4-(3-methylphenoxy)butyramide Formula: C23H28N2O3 MolecularWeight: 380.48002

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=CC=C1)OCCCC(=O)NC(CC(C)C)C2=NC3=CC=CC=C3O2

Isomeric SMILES

CC1=CC(=CC=C1)OCCCC(=O)N[C@@H](CC(C)C)C2=NC3=CC=CC=C3O2

InChI

InChI=1S/C23H28N2O3/c1-16(2)14-20(23-25-19-10-4-5-11-21(19)28-23)24-22(26)12-7-13-27-18-9-6-8-17(3)15-18/h4-6,8-11,15-16,20H,7,12-14H2,1-3H3,(H,24,26)/t20-/m0/s1