3-[5-methyl-4-methylsulfonyl-2-[(Z)-(2-oxidanylidene-1H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid

Systemtic Name: 3-[5-methyl-4-methylsulfonyl-2-[(Z)-(2-oxidanylidene-1H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid Openeye Name: 3-[5-methyl-4-methylsulfonyl-2-[(Z)-(2-oxoindolin-3-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid CAS Name: 3-[5-methyl-4-methylsulfonyl-2-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid IUPAC Name: 3-[5-methyl-4-methylsulfonyl-2-[(Z)-(2-oxo-1H-indol-3-ylidene)methyl]-1H-pyrrol-3-yl]propanoic acid Traditional Name: 3-[2-[(Z)-(2-ketoindolin-3-ylidene)methyl]-4-mesyl-5-methyl-1H-pyrrol-3-yl]propionic acid Formula: C18H18N2O5S MolecularWeight: 374.41092

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=C(N1)C=C2C3=CC=CC=C3NC2=O)CCC(=O)O)S(=O)(=O)C

Isomeric SMILES

CC1=C(C(=C(N1)/C=C\2/C3=CC=CC=C3NC2=O)CCC(=O)O)S(=O)(=O)C

InChI

InChI=1S/C18H18N2O5S/c1-10-17(26(2,24)25)12(7-8-16(21)22)15(19-10)9-13-11-5-3-4-6-14(11)20-18(13)23/h3-6,9,19H,7-8H2,1-2H3,(H,20,23)(H,21,22)/b13-9-