(2S)-2-acetamido-3-methyl-N-[[(2R)-7-pyridin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]butanamide

Systemtic Name: (2S)-2-acetamido-3-methyl-N-[[(2R)-7-pyridin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]butanamide Openeye Name: (2S)-2-acetamido-3-methyl-N-[[(2R)-7-(2-pyridyl)-2,3-dihydrobenzofuran-2-yl]methyl]butanamide CAS Name: (2S)-2-acetamido-3-methyl-N-[[(2R)-7-(2-pyridinyl)-2,3-dihydrobenzofuran-2-yl]methyl]butanamide IUPAC Name: (2S)-2-acetamido-3-methyl-N-[[(2R)-7-pyridin-2-yl-2,3-dihydro-1-benzofuran-2-yl]methyl]butanamide Traditional Name: (2S)-2-acetamido-3-methyl-N-[[(2R)-7-(2-pyridyl)coumaran-2-yl]methyl]butyramide Formula: C21H25N3O3 MolecularWeight: 367.4415

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NCC1CC2=CC=CC(=C2O1)C3=CC=CC=N3)NC(=O)C

Isomeric SMILES

CC(C)[C@@H](C(=O)NC[C@H]1CC2=CC=CC(=C2O1)C3=CC=CC=N3)NC(=O)C

InChI

InChI=1S/C21H25N3O3/c1-13(2)19(24-14(3)25)21(26)23-12-16-11-15-7-6-8-17(20(15)27-16)18-9-4-5-10-22-18/h4-10,13,16,19H,11-12H2,1-3H3,(H,23,26)(H,24,25)/t16-,19+/m1/s1