5-(5,5-dimethyl-1,3-dioxan-2-yl)-4-(2-methoxy-2-oxidanylidene-ethyl)-3-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrole-2-carboxylic acid

Systemtic Name: 5-(5,5-dimethyl-1,3-dioxan-2-yl)-4-(2-methoxy-2-oxidanylidene-ethyl)-3-(3-methoxy-3-oxidanylidene-propyl)-1H-pyrrole-2-carboxylic acid Openeye Name: 5-(5,5-dimethyl-1,3-dioxan-2-yl)-4-(2-methoxy-2-oxo-ethyl)-3-(3-methoxy-3-oxo-propyl)-1H-pyrrole-2-carboxylic acid CAS Name: 5-(5,5-dimethyl-1,3-dioxan-2-yl)-4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylic acid IUPAC Name: 5-(5,5-dimethyl-1,3-dioxan-2-yl)-4-(2-methoxy-2-oxoethyl)-3-(3-methoxy-3-oxopropyl)-1H-pyrrole-2-carboxylic acid Traditional Name: 5-(5,5-dimethyl-1,3-dioxan-2-yl)-4-(2-keto-2-methoxy-ethyl)-3-(3-keto-3-methoxy-propyl)-1H-pyrrole-2-carboxylic acid Formula: C18H25NO8 MolecularWeight: 383.393

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Descriptors Computed from Structure

Canonical SMILES:

CC1(COC(OC1)C2=C(C(=C(N2)C(=O)O)CCC(=O)OC)CC(=O)OC)C

Isomeric SMILES

CC1(COC(OC1)C2=C(C(=C(N2)C(=O)O)CCC(=O)OC)CC(=O)OC)C

InChI

InChI=1S/C18H25NO8/c1-18(2)8-26-17(27-9-18)15-11(7-13(21)25-4)10(5-6-12(20)24-3)14(19-15)16(22)23/h17,19H,5-9H2,1-4H3,(H,22,23)