3-tert-butyl-5-phenyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]pyrazole

Systemtic Name: 3-tert-butyl-5-phenyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]pyrazole Openeye Name: 3-tert-butyl-5-phenyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]pyrazole CAS Name: 3-tert-butyl-5-phenyl-1-[4-[3-(1-pyrrolidinyl)propoxy]phenyl]pyrazole IUPAC Name: 3-tert-butyl-5-phenyl-1-[4-(3-pyrrolidin-1-ylpropoxy)phenyl]pyrazole Traditional Name: 3-tert-butyl-5-phenyl-1-[4-(3-pyrrolidinopropoxy)phenyl]pyrazole Formula: C26H33N3O MolecularWeight: 403.55972

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)OCCCN4CCCC4

Isomeric SMILES

CC(C)(C)C1=NN(C(=C1)C2=CC=CC=C2)C3=CC=C(C=C3)OCCCN4CCCC4

InChI

InChI=1S/C26H33N3O/c1-26(2,3)25-20-24(21-10-5-4-6-11-21)29(27-25)22-12-14-23(15-13-22)30-19-9-18-28-16-7-8-17-28/h4-6,10-15,20H,7-9,16-19H2,1-3H3