N-[3-methoxy-4-(2-phenylethanoylamino)phenyl]-4-nitro-benzamide

Systemtic Name: N-[3-methoxy-4-(2-phenylethanoylamino)phenyl]-4-nitro-benzamide Openeye Name: N-[3-methoxy-4-[(2-phenylacetyl)amino]phenyl]-4-nitro-benzamide CAS Name: N-[3-methoxy-4-[(1-oxo-2-phenylethyl)amino]phenyl]-4-nitrobenzamide IUPAC Name: N-[3-methoxy-4-[(2-phenylacetyl)amino]phenyl]-4-nitrobenzamide Traditional Name: N-[3-methoxy-4-[(2-phenylacetyl)amino]phenyl]-4-nitro-benzamide Formula: C22H19N3O5 MolecularWeight: 405.40336

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CC3=CC=CC=C3

Isomeric SMILES

COC1=C(C=CC(=C1)NC(=O)C2=CC=C(C=C2)[N+](=O)[O-])NC(=O)CC3=CC=CC=C3

InChI

InChI=1S/C22H19N3O5/c1-30-20-14-17(23-22(27)16-7-10-18(11-8-16)25(28)29)9-12-19(20)24-21(26)13-15-5-3-2-4-6-15/h2-12,14H,13H2,1H3,(H,23,27)(H,24,26)