2-acetamido-5-[[(2S)-1-methoxy-3-(2-methyl-4-oxidanyl-phenyl)-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid

Systemtic Name: 2-acetamido-5-[[(2S)-1-methoxy-3-(2-methyl-4-oxidanyl-phenyl)-1-oxidanylidene-propan-2-yl]amino]-5-oxidanylidene-pentanoic acid Openeye Name: 2-acetamido-5-[[(1S)-1-[(4-hydroxy-2-methyl-phenyl)methyl]-2-methoxy-2-oxo-ethyl]amino]-5-oxo-pentanoic acid CAS Name: 2-acetamido-5-[[(2S)-3-(4-hydroxy-2-methylphenyl)-1-methoxy-1-oxopropan-2-yl]amino]-5-oxopentanoic acid IUPAC Name: 2-acetamido-5-[[(2S)-3-(4-hydroxy-2-methylphenyl)-1-methoxy-1-oxopropan-2-yl]amino]-5-oxopentanoic acid Traditional Name: 2-acetamido-5-[[(1S)-1-(4-hydroxy-2-methyl-benzyl)-2-keto-2-methoxy-ethyl]amino]-5-keto-valeric acid Formula: C18H24N2O7 MolecularWeight: 380.39236

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=CC(=C1)O)CC(C(=O)OC)NC(=O)CCC(C(=O)O)NC(=O)C

Isomeric SMILES

CC1=C(C=CC(=C1)O)C[C@@H](C(=O)OC)NC(=O)CCC(C(=O)O)NC(=O)C

InChI

InChI=1S/C18H24N2O7/c1-10-8-13(22)5-4-12(10)9-15(18(26)27-3)20-16(23)7-6-14(17(24)25)19-11(2)21/h4-5,8,14-15,22H,6-7,9H2,1-3H3,(H,19,21)(H,20,23)(H,24,25)/t14?,15-/m0/s1