4-[[2-(4-ethoxyphenyl)ethylamino]methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid

Systemtic Name: 4-[[2-(4-ethoxyphenyl)ethylamino]methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid Openeye Name: 4-[[2-(4-ethoxyphenyl)ethylamino]methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid CAS Name: 4-[[2-(4-ethoxyphenyl)ethylamino]methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid IUPAC Name: 4-[[2-(4-ethoxyphenyl)ethylamino]methyl]-2,5-dimethyl-1H-pyrrole-3-carboxylic acid Traditional Name: 2,5-dimethyl-4-[(2-p-phenetylethylamino)methyl]-1H-pyrrole-3-carboxylic acid Formula: C18H24N2O3 MolecularWeight: 316.39476

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=C(C=C1)CCNCC2=C(NC(=C2C(=O)O)C)C

Isomeric SMILES

CCOC1=CC=C(C=C1)CCNCC2=C(NC(=C2C(=O)O)C)C

InChI

InChI=1S/C18H24N2O3/c1-4-23-15-7-5-14(6-8-15)9-10-19-11-16-12(2)20-13(3)17(16)18(21)22/h5-8,19-20H,4,9-11H2,1-3H3,(H,21,22)