[4-methyl-2-[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]phenyl] ethanoate

Systemtic Name: [4-methyl-2-[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]phenyl] ethanoate Openeye Name: [4-methyl-2-[(E)-3-(5-nitro-2-furyl)prop-2-enoyl]phenyl] acetate CAS Name: acetic acid [4-methyl-2-[(E)-3-(5-nitro-2-furanyl)-1-oxoprop-2-enyl]phenyl] ester IUPAC Name: [4-methyl-2-[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]phenyl] acetate Traditional Name: acetic acid [4-methyl-2-[(E)-3-(5-nitro-2-furyl)acryloyl]phenyl] ester Formula: C16H13NO6 MolecularWeight: 315.27752

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)OC(=O)C)C(=O)C=CC2=CC=C(O2)[N+](=O)[O-]

Isomeric SMILES

CC1=CC(=C(C=C1)OC(=O)C)C(=O)/C=C/C2=CC=C(O2)[N+](=O)[O-]

InChI

InChI=1S/C16H13NO6/c1-10-3-7-15(22-11(2)18)13(9-10)14(19)6-4-12-5-8-16(23-12)17(20)21/h3-9H,1-2H3/b6-4+