(2S)-2-[2-[3-(dimethylamino)phenoxy]ethanoylamino]-4-methyl-pentanoate

Systemtic Name: (2S)-2-[2-[3-(dimethylamino)phenoxy]ethanoylamino]-4-methyl-pentanoate Openeye Name: (2S)-2-[[2-[3-(dimethylamino)phenoxy]acetyl]amino]-4-methyl-pentanoate CAS Name: (2S)-2-[[2-[3-(dimethylamino)phenoxy]-1-oxoethyl]amino]-4-methylpentanoate IUPAC Name: (2S)-2-[[2-[3-(dimethylamino)phenoxy]acetyl]amino]-4-methylpentanoate Traditional Name: (2S)-2-[[2-[3-(dimethylamino)phenoxy]acetyl]amino]-4-methyl-valerate Formula: C16H23N2O4- MolecularWeight: 307.36482

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)[O-])NC(=O)COC1=CC=CC(=C1)N(C)C

Isomeric SMILES

CC(C)C[C@@H](C(=O)[O-])NC(=O)COC1=CC=CC(=C1)N(C)C

InChI

InChI=1S/C16H24N2O4/c1-11(2)8-14(16(20)21)17-15(19)10-22-13-7-5-6-12(9-13)18(3)4/h5-7,9,11,14H,8,10H2,1-4H3,(H,17,19)(H,20,21)/p-1/t14-/m0/s1