2-dimethylaminoethyl (5Z)-5-[(3-cyclopropyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate

Systemtic Name: 2-dimethylaminoethyl (5Z)-5-[(3-cyclopropyl-5-oxidanylidene-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Openeye Name: 2-dimethylaminoethyl (5Z)-5-[(3-cyclopropyl-5-oxo-1,2-dihydropyrazol-4-yl)methylene]pyrrole-3-carboxylate CAS Name: (5Z)-5-[(3-cyclopropyl-5-oxo-1,2-dihydropyrazol-4-yl)methylidene]-3-pyrrolecarboxylic acid 2-dimethylaminoethyl ester IUPAC Name: 2-dimethylaminoethyl (5Z)-5-[(3-cyclopropyl-5-oxo-1,2-dihydropyrazol-4-yl)methylidene]pyrrole-3-carboxylate Traditional Name: (5Z)-5-[(3-cyclopropyl-5-keto-3-pyrazolin-4-yl)methylene]pyrrole-3-carboxylic acid 2-dimethylaminoethyl ester Formula: C16H20N4O3 MolecularWeight: 316.355

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Descriptors Computed from Structure

Canonical SMILES:

CN(C)CCOC(=O)C1=CC(=CC2=C(NNC2=O)C3CC3)N=C1

Isomeric SMILES

CN(C)CCOC(=O)C1=C/C(=C/C2=C(NNC2=O)C3CC3)/N=C1

InChI

InChI=1S/C16H20N4O3/c1-20(2)5-6-23-16(22)11-7-12(17-9-11)8-13-14(10-3-4-10)18-19-15(13)21/h7-10H,3-6H2,1-2H3,(H2,18,19,21)/b12-8-