N-[[3-(2-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl]-1-methoxy-butan-2-amine

Systemtic Name: N-[[3-(2-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl]-1-methoxy-butan-2-amine Openeye Name: N-[[3-(2-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl]-1-methoxy-butan-2-amine CAS Name: N-[[3-(2-chlorophenyl)-1-(4-methoxyphenyl)-4-pyrazolyl]methyl]-1-methoxy-2-butanamine IUPAC Name: N-[[3-(2-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl]-1-methoxybutan-2-amine Traditional Name: [3-(2-chlorophenyl)-1-(4-methoxyphenyl)pyrazol-4-yl]methyl-[1-(methoxymethyl)propyl]amine Formula: C22H26ClN3O2 MolecularWeight: 399.91374

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Descriptors Computed from Structure

Canonical SMILES:

CCC(COC)NCC1=CN(N=C1C2=CC=CC=C2Cl)C3=CC=C(C=C3)OC

Isomeric SMILES

CCC(COC)NCC1=CN(N=C1C2=CC=CC=C2Cl)C3=CC=C(C=C3)OC

InChI

InChI=1S/C22H26ClN3O2/c1-4-17(15-27-2)24-13-16-14-26(18-9-11-19(28-3)12-10-18)25-22(16)20-7-5-6-8-21(20)23/h5-12,14,17,24H,4,13,15H2,1-3H3