deuterio 1-(2-acetyloxyethyl)-2-methyl-5-phenyl-pyrrole-3-carboxylate

Systemtic Name: deuterio 1-(2-acetyloxyethyl)-2-methyl-5-phenyl-pyrrole-3-carboxylate Openeye Name: deuterio 1-(2-acetoxyethyl)-2-methyl-5-phenyl-pyrrole-3-carboxylate CAS Name: 1-(2-acetyloxyethyl)-2-methyl-5-phenyl-3-pyrrolecarboxylic acid deuterio ester IUPAC Name: deuterio 1-(2-acetyloxyethyl)-2-methyl-5-phenylpyrrole-3-carboxylate Traditional Name: 1-(2-acetoxyethyl)-2-methyl-5-phenyl-pyrrole-3-carboxylic acid deuterio ester Formula: C16H17NO4 MolecularWeight: 288.316642

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C=C(N1CCOC(=O)C)C2=CC=CC=C2)C(=O)O

Isomeric SMILES

[2H]OC(=O)C1=C(N(C(=C1)C2=CC=CC=C2)CCOC(=O)C)C

InChI

InChI=1S/C16H17NO4/c1-11-14(16(19)20)10-15(13-6-4-3-5-7-13)17(11)8-9-21-12(2)18/h3-7,10H,8-9H2,1-2H3,(H,19,20)/i/hD