3-(5-ethyl-2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)-1-(phenylmethyl)-4-piperidin-1-yl-pyrrole-2,5-dione

Systemtic Name: 3-(5-ethyl-2-methyl-3-oxidanylidene-1H-pyrazol-4-yl)-1-(phenylmethyl)-4-piperidin-1-yl-pyrrole-2,5-dione Openeye Name: 1-benzyl-3-(5-ethyl-2-methyl-3-oxo-1H-pyrazol-4-yl)-4-(1-piperidyl)pyrrole-2,5-dione CAS Name: 3-(5-ethyl-2-methyl-3-oxo-1H-pyrazol-4-yl)-1-(phenylmethyl)-4-(1-piperidinyl)pyrrole-2,5-dione IUPAC Name: 1-benzyl-3-(5-ethyl-2-methyl-3-oxo-1H-pyrazol-4-yl)-4-piperidin-1-ylpyrrole-2,5-dione Traditional Name: 1-benzyl-3-(3-ethyl-5-keto-1-methyl-3-pyrazolin-4-yl)-4-piperidino-3-pyrroline-2,5-quinone Formula: C22H26N4O3 MolecularWeight: 394.46684

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=C(C(=O)N(N1)C)C2=C(C(=O)N(C2=O)CC3=CC=CC=C3)N4CCCCC4

Isomeric SMILES

CCC1=C(C(=O)N(N1)C)C2=C(C(=O)N(C2=O)CC3=CC=CC=C3)N4CCCCC4

InChI

InChI=1S/C22H26N4O3/c1-3-16-17(20(27)24(2)23-16)18-19(25-12-8-5-9-13-25)22(29)26(21(18)28)14-15-10-6-4-7-11-15/h4,6-7,10-11,23H,3,5,8-9,12-14H2,1-2H3