ethyl 4-azanyl-1-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: ethyl 4-azanyl-1-[1,3-bis(oxidanyl)propan-2-yloxymethyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: ethyl 4-amino-1-[[2-hydroxy-1-(hydroxymethyl)ethoxy]methyl]-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 4-amino-1-(1,3-dihydroxypropan-2-yloxymethyl)-2-methyl-5-phenyl-3-pyrrolecarboxylic acid ethyl ester IUPAC Name: ethyl 4-amino-1-(1,3-dihydroxypropan-2-yloxymethyl)-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 4-amino-1-[(2-hydroxy-1-methylol-ethoxy)methyl]-2-methyl-5-phenyl-pyrrole-3-carboxylic acid ethyl ester Formula: C18H24N2O5 MolecularWeight: 348.39356

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(N(C(=C1N)C2=CC=CC=C2)COC(CO)CO)C

Isomeric SMILES

CCOC(=O)C1=C(N(C(=C1N)C2=CC=CC=C2)COC(CO)CO)C

InChI

InChI=1S/C18H24N2O5/c1-3-24-18(23)15-12(2)20(11-25-14(9-21)10-22)17(16(15)19)13-7-5-4-6-8-13/h4-8,14,21-22H,3,9-11,19H2,1-2H3