N-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]-4-methoxy-3-nitro-benzamide

Systemtic Name: N-[2-[(3-bromophenyl)amino]-2-oxidanylidene-ethyl]-4-methoxy-3-nitro-benzamide Openeye Name: N-[2-(3-bromoanilino)-2-oxo-ethyl]-4-methoxy-3-nitro-benzamide CAS Name: N-[2-(3-bromoanilino)-2-oxoethyl]-4-methoxy-3-nitrobenzamide IUPAC Name: N-[2-(3-bromoanilino)-2-oxoethyl]-4-methoxy-3-nitrobenzamide Traditional Name: N-[2-(3-bromoanilino)-2-keto-ethyl]-4-methoxy-3-nitro-benzamide Formula: C16H14BrN3O5 MolecularWeight: 408.20346

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=CC(=CC=C2)Br)[N+](=O)[O-]

Isomeric SMILES

COC1=C(C=C(C=C1)C(=O)NCC(=O)NC2=CC(=CC=C2)Br)[N+](=O)[O-]

InChI

InChI=1S/C16H14BrN3O5/c1-25-14-6-5-10(7-13(14)20(23)24)16(22)18-9-15(21)19-12-4-2-3-11(17)8-12/h2-8H,9H2,1H3,(H,18,22)(H,19,21)