3-nitro-N-[4-(3-phenylpropanoylamino)phenyl]benzamide

Systemtic Name: 3-nitro-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Openeye Name: 3-nitro-N-[4-(3-phenylpropanoylamino)phenyl]benzamide CAS Name: 3-nitro-N-[4-[(1-oxo-3-phenylpropyl)amino]phenyl]benzamide IUPAC Name: 3-nitro-N-[4-(3-phenylpropanoylamino)phenyl]benzamide Traditional Name: N-[4-(hydrocinnamoylamino)phenyl]-3-nitro-benzamide Formula: C22H19N3O4 MolecularWeight: 389.40396

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

Isomeric SMILES

C1=CC=C(C=C1)CCC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC(=CC=C3)[N+](=O)[O-]

InChI

InChI=1S/C22H19N3O4/c26-21(14-9-16-5-2-1-3-6-16)23-18-10-12-19(13-11-18)24-22(27)17-7-4-8-20(15-17)25(28)29/h1-8,10-13,15H,9,14H2,(H,23,26)(H,24,27)