3-chloranyl-N-[(1-methyl-3-propan-2-yl-pyrazol-4-yl)methyl]aniline

Systemtic Name: 3-chloranyl-N-[(1-methyl-3-propan-2-yl-pyrazol-4-yl)methyl]aniline Openeye Name: 3-chloro-N-[(3-isopropyl-1-methyl-pyrazol-4-yl)methyl]aniline CAS Name: 3-chloro-N-[(1-methyl-3-propan-2-yl-4-pyrazolyl)methyl]aniline IUPAC Name: 3-chloro-N-[(1-methyl-3-propan-2-ylpyrazol-4-yl)methyl]aniline Traditional Name: (3-chlorophenyl)-[(3-isopropyl-1-methyl-pyrazol-4-yl)methyl]amine Formula: C14H18ClN3 MolecularWeight: 263.76582

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)C1=NN(C=C1CNC2=CC(=CC=C2)Cl)C

Isomeric SMILES

CC(C)C1=NN(C=C1CNC2=CC(=CC=C2)Cl)C

InChI

InChI=1S/C14H18ClN3/c1-10(2)14-11(9-18(3)17-14)8-16-13-6-4-5-12(15)7-13/h4-7,9-10,16H,8H2,1-3H3