ethyl 4-[[4-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylhydrazinylidene]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[[4-(2,5-dimethylpyrrol-1-yl)phenyl]carbonylhydrazinylidene]piperidine-1-carboxylate Openeye Name: ethyl 4-[[4-(2,5-dimethylpyrrol-1-yl)benzoyl]hydrazono]piperidine-1-carboxylate CAS Name: 4-[[[4-(2,5-dimethyl-1-pyrrolyl)phenyl]-oxomethyl]hydrazinylidene]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[4-(2,5-dimethylpyrrol-1-yl)benzoyl]hydrazinylidene]piperidine-1-carboxylate Traditional Name: 4-[[4-(2,5-dimethylpyrrol-1-yl)benzoyl]hydrazono]piperidine-1-carboxylic acid ethyl ester Formula: C21H26N4O3 MolecularWeight: 382.45614

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(=NNC(=O)C2=CC=C(C=C2)N3C(=CC=C3C)C)CC1

Isomeric SMILES

CCOC(=O)N1CCC(=NNC(=O)C2=CC=C(C=C2)N3C(=CC=C3C)C)CC1

InChI

InChI=1S/C21H26N4O3/c1-4-28-21(27)24-13-11-18(12-14-24)22-23-20(26)17-7-9-19(10-8-17)25-15(2)5-6-16(25)3/h5-10H,4,11-14H2,1-3H3,(H,23,26)