methyl 2-methyl-6-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino]benzoate

Systemtic Name: methyl 2-methyl-6-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino]benzoate Openeye Name: methyl 2-methyl-6-[[(E)-3-(5-nitro-2-furyl)prop-2-enoyl]amino]benzoate CAS Name: 2-methyl-6-[[(E)-3-(5-nitro-2-furanyl)-1-oxoprop-2-enyl]amino]benzoic acid methyl ester IUPAC Name: methyl 2-methyl-6-[[(E)-3-(5-nitrofuran-2-yl)prop-2-enoyl]amino]benzoate Traditional Name: 2-methyl-6-[[(E)-3-(5-nitro-2-furyl)acryloyl]amino]benzoic acid methyl ester Formula: C16H14N2O6 MolecularWeight: 330.29216

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C16H14N2O6/c1-10-4-3-5-12(15(10)16(20)23-2)17-13(19)8-6-11-7-9-14(24-11)18(21)22/h3-9H,1-2H3,(H,17,19)/b8-6+