3-[5-ethoxycarbonyl-2-[(E)-(6-methoxy-2-oxidanylidene-1H-indol-3-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid

Systemtic Name: 3-[5-ethoxycarbonyl-2-[(E)-(6-methoxy-2-oxidanylidene-1H-indol-3-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid Openeye Name: 3-[5-ethoxycarbonyl-2-[(E)-(6-methoxy-2-oxo-indolin-3-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid CAS Name: 3-[5-ethoxycarbonyl-2-[(E)-(6-methoxy-2-oxo-1H-indol-3-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid IUPAC Name: 3-[5-ethoxycarbonyl-2-[(E)-(6-methoxy-2-oxo-1H-indol-3-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propanoic acid Traditional Name: 3-[5-carbethoxy-2-[(E)-(2-keto-6-methoxy-indolin-3-ylidene)methyl]-4-methyl-1H-pyrrol-3-yl]propionic acid Formula: C21H22N2O6 MolecularWeight: 398.40918

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)C=C2C3=C(C=C(C=C3)OC)NC2=O)CCC(=O)O)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)/C=C/2\C3=C(C=C(C=C3)OC)NC2=O)CCC(=O)O)C

InChI

InChI=1S/C21H22N2O6/c1-4-29-21(27)19-11(2)13(7-8-18(24)25)17(22-19)10-15-14-6-5-12(28-3)9-16(14)23-20(15)26/h5-6,9-10,22H,4,7-8H2,1-3H3,(H,23,26)(H,24,25)/b15-10+