4-[(E)-[3,5-dimethyl-4-(piperidin-1-ylmethyl)pyrrol-2-ylidene]methyl]-5-(1,2-oxazol-5-yl)-1,2-dihydropyrazol-3-one

Systemtic Name: 4-[(E)-[3,5-dimethyl-4-(piperidin-1-ylmethyl)pyrrol-2-ylidene]methyl]-5-(1,2-oxazol-5-yl)-1,2-dihydropyrazol-3-one Openeye Name: 4-[(E)-[3,5-dimethyl-4-(1-piperidylmethyl)pyrrol-2-ylidene]methyl]-5-isoxazol-5-yl-1,2-dihydropyrazol-3-one CAS Name: 4-[(E)-[3,5-dimethyl-4-(1-piperidinylmethyl)-2-pyrrolylidene]methyl]-5-(5-isoxazolyl)-1,2-dihydropyrazol-3-one IUPAC Name: 4-[(E)-[3,5-dimethyl-4-(piperidin-1-ylmethyl)pyrrol-2-ylidene]methyl]-5-(1,2-oxazol-5-yl)-1,2-dihydropyrazol-3-one Traditional Name: 4-[(E)-[3,5-dimethyl-4-(piperidinomethyl)pyrrol-2-ylidene]methyl]-5-isoxazol-5-yl-3-pyrazolin-3-one Formula: C19H23N5O2 MolecularWeight: 353.41822

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(=NC1=CC2=C(NNC2=O)C3=CC=NO3)C)CN4CCCCC4

Isomeric SMILES

CC\1=C(C(=N/C1=C/C2=C(NNC2=O)C3=CC=NO3)C)CN4CCCCC4

InChI

InChI=1S/C19H23N5O2/c1-12-15(11-24-8-4-3-5-9-24)13(2)21-16(12)10-14-18(22-23-19(14)25)17-6-7-20-26-17/h6-7,10H,3-5,8-9,11H2,1-2H3,(H2,22,23,25)/b16-10+