3,3-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]butanamide

Systemtic Name: 3,3-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]butanamide Openeye Name: 3,3-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]butanamide CAS Name: 3,3-dimethyl-N-[2-(4-morpholin-4-iumyl)ethyl]-N-[(2-phenyl-3-pyrazolyl)methyl]butanamide IUPAC Name: 3,3-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]butanamide Traditional Name: 3,3-dimethyl-N-(2-morpholin-4-ium-4-ylethyl)-N-[(2-phenylpyrazol-3-yl)methyl]butyramide Formula: C22H33N4O2+ MolecularWeight: 385.52302

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)CC(=O)N(CC[NH+]1CCOCC1)CC2=CC=NN2C3=CC=CC=C3

Isomeric SMILES

CC(C)(C)CC(=O)N(CC[NH+]1CCOCC1)CC2=CC=NN2C3=CC=CC=C3

InChI

InChI=1S/C22H32N4O2/c1-22(2,3)17-21(27)25(12-11-24-13-15-28-16-14-24)18-20-9-10-23-26(20)19-7-5-4-6-8-19/h4-10H,11-18H2,1-3H3/p+1