(phenylmethyl) 2-[(E)-2-nitroethenyl]pyrrole-1-carboxylate

Systemtic Name: (phenylmethyl) 2-[(E)-2-nitroethenyl]pyrrole-1-carboxylate Openeye Name: benzyl 2-[(E)-2-nitrovinyl]pyrrole-1-carboxylate CAS Name: 2-[(E)-2-nitroethenyl]-1-pyrrolecarboxylic acid (phenylmethyl) ester IUPAC Name: benzyl 2-[(E)-2-nitroethenyl]pyrrole-1-carboxylate Traditional Name: 2-[(E)-2-nitrovinyl]pyrrole-1-carboxylic acid benzyl ester Formula: C14H12N2O4 MolecularWeight: 272.25608

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC(=O)N2C=CC=C2C=C[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC(=O)N2C=CC=C2/C=C/[N+](=O)[O-]

InChI

InChI=1S/C14H12N2O4/c17-14(20-11-12-5-2-1-3-6-12)15-9-4-7-13(15)8-10-16(18)19/h1-10H,11H2/b10-8+