[(3E)-3-cyano-2-methyl-3-phenylmethoxyimino-propyl] 1H-pyrrole-2-carboxylate

Systemtic Name: [(3E)-3-cyano-2-methyl-3-phenylmethoxyimino-propyl] 1H-pyrrole-2-carboxylate Openeye Name: [(3E)-3-benzyloxyimino-3-cyano-2-methyl-propyl] 1H-pyrrole-2-carboxylate CAS Name: 1H-pyrrole-2-carboxylic acid [(3E)-3-cyano-2-methyl-3-phenylmethoxyiminopropyl] ester IUPAC Name: [(3E)-3-cyano-2-methyl-3-phenylmethoxyiminopropyl] 1H-pyrrole-2-carboxylate Traditional Name: 1H-pyrrole-2-carboxylic acid [(3E)-3-benzyloximino-3-cyano-2-methyl-propyl] ester Formula: C17H17N3O3 MolecularWeight: 311.33518

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Descriptors Computed from Structure

Canonical SMILES:

CC(COC(=O)C1=CC=CN1)C(=NOCC2=CC=CC=C2)C#N

Isomeric SMILES

CC(COC(=O)C1=CC=CN1)/C(=N\OCC2=CC=CC=C2)/C#N

InChI

InChI=1S/C17H17N3O3/c1-13(11-22-17(21)15-8-5-9-19-15)16(10-18)20-23-12-14-6-3-2-4-7-14/h2-9,13,19H,11-12H2,1H3/b20-16-