ethyl 1-[5-[(E)-[(1-methylpyrrol-2-yl)carbonylhydrazinylidene]methyl]pyridin-2-yl]piperidine-4-carboxylate

Systemtic Name: ethyl 1-[5-[(E)-[(1-methylpyrrol-2-yl)carbonylhydrazinylidene]methyl]pyridin-2-yl]piperidine-4-carboxylate Openeye Name: ethyl 1-[5-[(E)-[(1-methylpyrrole-2-carbonyl)hydrazono]methyl]-2-pyridyl]piperidine-4-carboxylate CAS Name: 1-[5-[(E)-[[(1-methyl-2-pyrrolyl)-oxomethyl]hydrazinylidene]methyl]-2-pyridinyl]-4-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 1-[5-[(E)-[(1-methylpyrrole-2-carbonyl)hydrazinylidene]methyl]pyridin-2-yl]piperidine-4-carboxylate Traditional Name: 1-[5-[(E)-[(1-methylpyrrole-2-carbonyl)hydrazono]methyl]-2-pyridyl]isonipecotic acid ethyl ester Formula: C20H25N5O3 MolecularWeight: 383.4442

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1CCN(CC1)C2=NC=C(C=C2)C=NNC(=O)C3=CC=CN3C

Isomeric SMILES

CCOC(=O)C1CCN(CC1)C2=NC=C(C=C2)/C=N/NC(=O)C3=CC=CN3C

InChI

InChI=1S/C20H25N5O3/c1-3-28-20(27)16-8-11-25(12-9-16)18-7-6-15(13-21-18)14-22-23-19(26)17-5-4-10-24(17)2/h4-7,10,13-14,16H,3,8-9,11-12H2,1-2H3,(H,23,26)/b22-14+