3-[(3-ethanoyl-5-ethoxycarbonyl-4-methyl-1H-pyrrol-2-yl)methyl]-1H-indole-5-carboxylic acid

Systemtic Name: 3-[(3-ethanoyl-5-ethoxycarbonyl-4-methyl-1H-pyrrol-2-yl)methyl]-1H-indole-5-carboxylic acid Openeye Name: 3-[(3-acetyl-5-ethoxycarbonyl-4-methyl-1H-pyrrol-2-yl)methyl]-1H-indole-5-carboxylic acid CAS Name: 3-[(3-acetyl-5-ethoxycarbonyl-4-methyl-1H-pyrrol-2-yl)methyl]-1H-indole-5-carboxylic acid IUPAC Name: 3-[(3-acetyl-5-ethoxycarbonyl-4-methyl-1H-pyrrol-2-yl)methyl]-1H-indole-5-carboxylic acid Traditional Name: 3-[(3-acetyl-5-carbethoxy-4-methyl-1H-pyrrol-2-yl)methyl]-1H-indole-5-carboxylic acid Formula: C20H20N2O5 MolecularWeight: 368.3832

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(C(=C(N1)CC2=CNC3=C2C=C(C=C3)C(=O)O)C(=O)C)C

Isomeric SMILES

CCOC(=O)C1=C(C(=C(N1)CC2=CNC3=C2C=C(C=C3)C(=O)O)C(=O)C)C

InChI

InChI=1S/C20H20N2O5/c1-4-27-20(26)18-10(2)17(11(3)23)16(22-18)8-13-9-21-15-6-5-12(19(24)25)7-14(13)15/h5-7,9,21-22H,4,8H2,1-3H3,(H,24,25)