5-(aminomethyl)-1-methyl-2-phenyl-4-propan-2-yl-pyrazol-3-one

Systemtic Name: 5-(aminomethyl)-1-methyl-2-phenyl-4-propan-2-yl-pyrazol-3-one Openeye Name: 5-(aminomethyl)-4-isopropyl-1-methyl-2-phenyl-pyrazol-3-one CAS Name: 5-(aminomethyl)-1-methyl-2-phenyl-4-propan-2-yl-3-pyrazolone IUPAC Name: 5-(aminomethyl)-1-methyl-2-phenyl-4-propan-2-ylpyrazol-3-one Traditional Name: 5-(aminomethyl)-4-isopropyl-1-methyl-2-phenyl-3-pyrazolin-3-one Formula: C14H19N3O MolecularWeight: 245.32016

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=C(N(N(C1=O)C2=CC=CC=C2)C)CN

Isomeric SMILES

CC(C)C1=C(N(N(C1=O)C2=CC=CC=C2)C)CN

InChI

InChI=1S/C14H19N3O/c1-10(2)13-12(9-15)16(3)17(14(13)18)11-7-5-4-6-8-11/h4-8,10H,9,15H2,1-3H3