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

Systemtic Name: 4-[[(2-ethoxyphenyl)methylamino]methyl]-2,5-dimethyl-1-[(4-methylphenyl)methyl]pyrrole-3-carboxylic acid Openeye Name: 4-[[(2-ethoxyphenyl)methylamino]methyl]-2,5-dimethyl-1-(p-tolylmethyl)pyrrole-3-carboxylic acid CAS Name: 4-[[(2-ethoxyphenyl)methylamino]methyl]-2,5-dimethyl-1-[(4-methylphenyl)methyl]-3-pyrrolecarboxylic acid IUPAC Name: 4-[[(2-ethoxyphenyl)methylamino]methyl]-2,5-dimethyl-1-[(4-methylphenyl)methyl]pyrrole-3-carboxylic acid Traditional Name: 4-[[(2-ethoxybenzyl)amino]methyl]-2,5-dimethyl-1-(4-methylbenzyl)pyrrole-3-carboxylic acid Formula: C25H30N2O3 MolecularWeight: 406.5173

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Descriptors Computed from Structure

Canonical SMILES:

CCOC1=CC=CC=C1CNCC2=C(N(C(=C2C(=O)O)C)CC3=CC=C(C=C3)C)C

Isomeric SMILES

CCOC1=CC=CC=C1CNCC2=C(N(C(=C2C(=O)O)C)CC3=CC=C(C=C3)C)C

InChI

InChI=1S/C25H30N2O3/c1-5-30-23-9-7-6-8-21(23)14-26-15-22-18(3)27(19(4)24(22)25(28)29)16-20-12-10-17(2)11-13-20/h6-13,26H,5,14-16H2,1-4H3,(H,28,29)