3-[(1-methoxy-1-oxidanylidene-propan-2-yl)-(pyridin-3-ylmethyl)amino]-3-oxidanylidene-propanoic acid

Systemtic Name: 3-[(1-methoxy-1-oxidanylidene-propan-2-yl)-(pyridin-3-ylmethyl)amino]-3-oxidanylidene-propanoic acid Openeye Name: 3-[(2-methoxy-1-methyl-2-oxo-ethyl)-(3-pyridylmethyl)amino]-3-oxo-propanoic acid CAS Name: 3-[(1-methoxy-1-oxopropan-2-yl)-(3-pyridinylmethyl)amino]-3-oxopropanoic acid IUPAC Name: 3-[(1-methoxy-1-oxopropan-2-yl)-(pyridin-3-ylmethyl)amino]-3-oxopropanoic acid Traditional Name: 3-keto-3-[(2-keto-2-methoxy-1-methyl-ethyl)-(3-pyridylmethyl)amino]propionic acid Formula: C13H16N2O5 MolecularWeight: 280.27654

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Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)N(CC1=CN=CC=C1)C(=O)CC(=O)O

Isomeric SMILES

CC(C(=O)OC)N(CC1=CN=CC=C1)C(=O)CC(=O)O

InChI

InChI=1S/C13H16N2O5/c1-9(13(19)20-2)15(11(16)6-12(17)18)8-10-4-3-5-14-7-10/h3-5,7,9H,6,8H2,1-2H3,(H,17,18)