4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]morpholin-4-ium

Systemtic Name: 4-[(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)methyl]morpholin-4-ium Openeye Name: 4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]morpholin-4-ium CAS Name: 4-[(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)methyl]morpholin-4-ium IUPAC Name: 4-[(5-chloro-3-methyl-1-phenylpyrazol-4-yl)methyl]morpholin-4-ium Traditional Name: 4-[(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)methyl]morpholin-4-ium Formula: C15H19ClN3O+ MolecularWeight: 292.78386

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C[NH+]2CCOCC2)Cl)C3=CC=CC=C3

Isomeric SMILES

CC1=NN(C(=C1C[NH+]2CCOCC2)Cl)C3=CC=CC=C3

InChI

InChI=1S/C15H18ClN3O/c1-12-14(11-18-7-9-20-10-8-18)15(16)19(17-12)13-5-3-2-4-6-13/h2-6H,7-11H2,1H3/p+1