5-methoxycarbonyl-1-methyl-3-(1-phenylpropan-2-yl)pyrrole-2-carboxylic acid

Systemtic Name: 5-methoxycarbonyl-1-methyl-3-(1-phenylpropan-2-yl)pyrrole-2-carboxylic acid Openeye Name: 5-methoxycarbonyl-1-methyl-3-(1-methyl-2-phenyl-ethyl)pyrrole-2-carboxylic acid CAS Name: 5-methoxycarbonyl-1-methyl-3-(1-phenylpropan-2-yl)-2-pyrrolecarboxylic acid IUPAC Name: 5-methoxycarbonyl-1-methyl-3-(1-phenylpropan-2-yl)pyrrole-2-carboxylic acid Traditional Name: 5-carbomethoxy-1-methyl-3-(1-methyl-2-phenyl-ethyl)pyrrole-2-carboxylic acid Formula: C17H19NO4 MolecularWeight: 301.33706

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Descriptors Computed from Structure

Canonical SMILES:

CC(CC1=CC=CC=C1)C2=C(N(C(=C2)C(=O)OC)C)C(=O)O

Isomeric SMILES

CC(CC1=CC=CC=C1)C2=C(N(C(=C2)C(=O)OC)C)C(=O)O

InChI

InChI=1S/C17H19NO4/c1-11(9-12-7-5-4-6-8-12)13-10-14(17(21)22-3)18(2)15(13)16(19)20/h4-8,10-11H,9H2,1-3H3,(H,19,20)