4-nitro-N-[3-oxidanylidene-3-[(4-phenylmethoxyphenyl)amino]propyl]benzamide

Systemtic Name: 4-nitro-N-[3-oxidanylidene-3-[(4-phenylmethoxyphenyl)amino]propyl]benzamide Openeye Name: N-[3-(4-benzyloxyanilino)-3-oxo-propyl]-4-nitro-benzamide CAS Name: 4-nitro-N-[3-oxo-3-(4-phenylmethoxyanilino)propyl]benzamide IUPAC Name: 4-nitro-N-[3-oxo-3-(4-phenylmethoxyanilino)propyl]benzamide Traditional Name: N-[3-(4-benzoxyanilino)-3-keto-propyl]-4-nitro-benzamide Formula: C23H21N3O5 MolecularWeight: 419.42994

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)COC2=CC=C(C=C2)NC(=O)CCNC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C23H21N3O5/c27-22(14-15-24-23(28)18-6-10-20(11-7-18)26(29)30)25-19-8-12-21(13-9-19)31-16-17-4-2-1-3-5-17/h1-13H,14-16H2,(H,24,28)(H,25,27)