(4-pyrazol-1-ylphenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate

Systemtic Name: (4-pyrazol-1-ylphenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate Openeye Name: (4-pyrazol-1-ylphenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate CAS Name: (E)-3-(3-nitrophenyl)-2-propenoic acid [4-(1-pyrazolyl)phenyl]methyl ester IUPAC Name: (4-pyrazol-1-ylphenyl)methyl (E)-3-(3-nitrophenyl)prop-2-enoate Traditional Name: (E)-3-(3-nitrophenyl)acrylic acid (4-pyrazol-1-ylbenzyl) ester Formula: C19H15N3O4 MolecularWeight: 349.3401

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC(=CC(=C1)[N+](=O)[O-])C=CC(=O)OCC2=CC=C(C=C2)N3C=CC=N3

Isomeric SMILES

C1=CC(=CC(=C1)[N+](=O)[O-])/C=C/C(=O)OCC2=CC=C(C=C2)N3C=CC=N3

InChI

InChI=1S/C19H15N3O4/c23-19(10-7-15-3-1-4-18(13-15)22(24)25)26-14-16-5-8-17(9-6-16)21-12-2-11-20-21/h1-13H,14H2/b10-7+