N-[2-[(2-fluorophenyl)carbamoyl-(4-phenoxyphenyl)amino]ethyl]-3-nitro-benzamide

Systemtic Name: N-[2-[(2-fluorophenyl)carbamoyl-(4-phenoxyphenyl)amino]ethyl]-3-nitro-benzamide Openeye Name: N-[2-[N-[(2-fluorophenyl)carbamoyl]-4-phenoxy-anilino]ethyl]-3-nitro-benzamide CAS Name: N-[2-(N-[(2-fluoroanilino)-oxomethyl]-4-phenoxyanilino)ethyl]-3-nitrobenzamide IUPAC Name: N-[2-[N-[(2-fluorophenyl)carbamoyl]-4-phenoxyanilino]ethyl]-3-nitrobenzamide Traditional Name: N-[2-[N-[(2-fluorophenyl)carbamoyl]-4-phenoxy-anilino]ethyl]-3-nitro-benzamide Formula: C28H23FN4O5 MolecularWeight: 514.504423

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NC4=CC=CC=C4F

Isomeric SMILES

C1=CC=C(C=C1)OC2=CC=C(C=C2)N(CCNC(=O)C3=CC(=CC=C3)[N+](=O)[O-])C(=O)NC4=CC=CC=C4F

InChI

InChI=1S/C28H23FN4O5/c29-25-11-4-5-12-26(25)31-28(35)32(18-17-30-27(34)20-7-6-8-22(19-20)33(36)37)21-13-15-24(16-14-21)38-23-9-2-1-3-10-23/h1-16,19H,17-18H2,(H,30,34)(H,31,35)