3-[4-methoxy-3-(oxolan-2-yloxy)phenyl]-1-[(4-nitrophenyl)methyl]pyrazole

Systemtic Name: 3-[4-methoxy-3-(oxolan-2-yloxy)phenyl]-1-[(4-nitrophenyl)methyl]pyrazole Openeye Name: 3-(4-methoxy-3-tetrahydrofuran-2-yloxy-phenyl)-1-[(4-nitrophenyl)methyl]pyrazole CAS Name: 3-[4-methoxy-3-(2-oxolanyloxy)phenyl]-1-[(4-nitrophenyl)methyl]pyrazole IUPAC Name: 3-[4-methoxy-3-(oxolan-2-yloxy)phenyl]-1-[(4-nitrophenyl)methyl]pyrazole Traditional Name: 3-[4-methoxy-3-(tetrahydrofuryloxy)phenyl]-1-(4-nitrobenzyl)pyrazole Formula: C21H21N3O5 MolecularWeight: 395.40854

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C2=NN(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-])OC4CCCO4

Isomeric SMILES

COC1=C(C=C(C=C1)C2=NN(C=C2)CC3=CC=C(C=C3)[N+](=O)[O-])OC4CCCO4

InChI

InChI=1S/C21H21N3O5/c1-27-19-9-6-16(13-20(19)29-21-3-2-12-28-21)18-10-11-23(22-18)14-15-4-7-17(8-5-15)24(25)26/h4-11,13,21H,2-3,12,14H2,1H3