2-[4-[1-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]oxybutyl]-3,4-dihydro-1H-isoquinoline

Systemtic Name: 2-[4-[1-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]oxybutyl]-3,4-dihydro-1H-isoquinoline Openeye Name: 2-[4-[1-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]oxybutyl]-3,4-dihydro-1H-isoquinoline CAS Name: 2-[4-[[1-(3,4-dichlorophenyl)-5-methyl-3-pyrazolyl]oxy]butyl]-3,4-dihydro-1H-isoquinoline IUPAC Name: 2-[4-[1-(3,4-dichlorophenyl)-5-methylpyrazol-3-yl]oxybutyl]-3,4-dihydro-1H-isoquinoline Traditional Name: 2-[4-[1-(3,4-dichlorophenyl)-5-methyl-pyrazol-3-yl]oxybutyl]-3,4-dihydro-1H-isoquinoline Formula: C23H25Cl2N3O MolecularWeight: 430.3701

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=NN1C2=CC(=C(C=C2)Cl)Cl)OCCCCN3CCC4=CC=CC=C4C3

Isomeric SMILES

CC1=CC(=NN1C2=CC(=C(C=C2)Cl)Cl)OCCCCN3CCC4=CC=CC=C4C3

InChI

InChI=1S/C23H25Cl2N3O/c1-17-14-23(26-28(17)20-8-9-21(24)22(25)15-20)29-13-5-4-11-27-12-10-18-6-2-3-7-19(18)16-27/h2-3,6-9,14-15H,4-5,10-13,16H2,1H3