(3R)-3-[[(2S)-3-methyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]-6-phenyl-hexanoic acid

Systemtic Name: (3R)-3-[[(2S)-3-methyl-1-(methylamino)-1-oxidanylidene-butan-2-yl]carbamoyl]-6-phenyl-hexanoic acid Openeye Name: (3R)-3-[[(1S)-2-methyl-1-(methylcarbamoyl)propyl]carbamoyl]-6-phenyl-hexanoic acid CAS Name: (3R)-3-[[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]amino]-oxomethyl]-6-phenylhexanoic acid IUPAC Name: (3R)-3-[[(2S)-3-methyl-1-(methylamino)-1-oxobutan-2-yl]carbamoyl]-6-phenylhexanoic acid Traditional Name: (3R)-3-[[(1S)-2-methyl-1-(methylcarbamoyl)propyl]carbamoyl]-6-phenyl-hexanoic acid Formula: C19H28N2O4 MolecularWeight: 348.43662

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)NC)NC(=O)C(CCCC1=CC=CC=C1)CC(=O)O

Isomeric SMILES

CC(C)[C@@H](C(=O)NC)NC(=O)[C@H](CCCC1=CC=CC=C1)CC(=O)O

InChI

InChI=1S/C19H28N2O4/c1-13(2)17(19(25)20-3)21-18(24)15(12-16(22)23)11-7-10-14-8-5-4-6-9-14/h4-6,8-9,13,15,17H,7,10-12H2,1-3H3,(H,20,25)(H,21,24)(H,22,23)/t15-,17+/m1/s1