3-[2,4-dimethyl-5-[(Z)-(3-oxidanylideneisoindol-1-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid

Systemtic Name: 3-[2,4-dimethyl-5-[(Z)-(3-oxidanylideneisoindol-1-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid Openeye Name: 3-[2,4-dimethyl-5-[(Z)-(3-oxoisoindolin-1-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid CAS Name: 3-[2,4-dimethyl-5-[(Z)-(3-oxo-1-isoindolylidene)methyl]-1H-pyrrol-3-yl]propanoic acid IUPAC Name: 3-[2,4-dimethyl-5-[(Z)-(3-oxoisoindol-1-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid Traditional Name: 3-[5-[(Z)-(3-ketoisoindolin-1-ylidene)methyl]-2,4-dimethyl-1H-pyrrol-3-yl]propionic acid Formula: C18H18N2O3 MolecularWeight: 310.34712

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(NC(=C1CCC(=O)O)C)C=C2C3=CC=CC=C3C(=O)N2

Isomeric SMILES

CC1=C(NC(=C1CCC(=O)O)C)/C=C\2/C3=CC=CC=C3C(=O)N2

InChI

InChI=1S/C18H18N2O3/c1-10-12(7-8-17(21)22)11(2)19-15(10)9-16-13-5-3-4-6-14(13)18(23)20-16/h3-6,9,19H,7-8H2,1-2H3,(H,20,23)(H,21,22)/b16-9-