3-[5-(4-methoxyphenyl)-1-(3-oxidanidyl-3-oxidanylidene-propyl)pyrrol-2-yl]propanoate

Systemtic Name: 3-[5-(4-methoxyphenyl)-1-(3-oxidanidyl-3-oxidanylidene-propyl)pyrrol-2-yl]propanoate Openeye Name: 3-[5-(4-methoxyphenyl)-1-(3-oxido-3-oxo-propyl)pyrrol-2-yl]propanoate CAS Name: 3-[5-(4-methoxyphenyl)-1-(3-oxido-3-oxopropyl)-2-pyrrolyl]propanoate IUPAC Name: 3-[5-(4-methoxyphenyl)-1-(3-oxido-3-oxopropyl)pyrrol-2-yl]propanoate Traditional Name: 3-[1-(3-keto-3-oxido-propyl)-5-(4-methoxyphenyl)pyrrol-2-yl]propionate Formula: C17H17NO5-2 MolecularWeight: 315.32058

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)C2=CC=C(N2CCC(=O)[O-])CCC(=O)[O-]

Isomeric SMILES

COC1=CC=C(C=C1)C2=CC=C(N2CCC(=O)[O-])CCC(=O)[O-]

InChI

InChI=1S/C17H19NO5/c1-23-14-6-2-12(3-7-14)15-8-4-13(5-9-16(19)20)18(15)11-10-17(21)22/h2-4,6-8H,5,9-11H2,1H3,(H,19,20)(H,21,22)/p-2