(2S)-3-methyl-N-[(4-methylphenyl)methyl]-2-(2-phenoxyethanoylamino)butanamide

Systemtic Name: (2S)-3-methyl-N-[(4-methylphenyl)methyl]-2-(2-phenoxyethanoylamino)butanamide Openeye Name: (2S)-3-methyl-2-[(2-phenoxyacetyl)amino]-N-(p-tolylmethyl)butanamide CAS Name: (2S)-3-methyl-N-[(4-methylphenyl)methyl]-2-[(1-oxo-2-phenoxyethyl)amino]butanamide IUPAC Name: (2S)-3-methyl-N-[(4-methylphenyl)methyl]-2-[(2-phenoxyacetyl)amino]butanamide Traditional Name: (2S)-3-methyl-N-(4-methylbenzyl)-2-[(2-phenoxyacetyl)amino]butyramide Formula: C21H26N2O3 MolecularWeight: 354.44274

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CNC(=O)C(C(C)C)NC(=O)COC2=CC=CC=C2

Isomeric SMILES

CC1=CC=C(C=C1)CNC(=O)[C@H](C(C)C)NC(=O)COC2=CC=CC=C2

InChI

InChI=1S/C21H26N2O3/c1-15(2)20(21(25)22-13-17-11-9-16(3)10-12-17)23-19(24)14-26-18-7-5-4-6-8-18/h4-12,15,20H,13-14H2,1-3H3,(H,22,25)(H,23,24)/t20-/m0/s1