4-imidazol-1-yl-3-nitro-N-[1-[4-(propanoylamino)phenyl]ethyl]benzamide

Systemtic Name: 4-imidazol-1-yl-3-nitro-N-[1-[4-(propanoylamino)phenyl]ethyl]benzamide Openeye Name: 4-imidazol-1-yl-3-nitro-N-[1-[4-(propanoylamino)phenyl]ethyl]benzamide CAS Name: 4-(1-imidazolyl)-3-nitro-N-[1-[4-(1-oxopropylamino)phenyl]ethyl]benzamide IUPAC Name: 4-imidazol-1-yl-3-nitro-N-[1-[4-(propanoylamino)phenyl]ethyl]benzamide Traditional Name: 4-imidazol-1-yl-3-nitro-N-[1-(4-propionamidophenyl)ethyl]benzamide Formula: C21H21N5O4 MolecularWeight: 407.42254

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Descriptors Computed from Structure

Canonical SMILES:

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

Isomeric SMILES

CCC(=O)NC1=CC=C(C=C1)C(C)NC(=O)C2=CC(=C(C=C2)N3C=CN=C3)[N+](=O)[O-]

InChI

InChI=1S/C21H21N5O4/c1-3-20(27)24-17-7-4-15(5-8-17)14(2)23-21(28)16-6-9-18(19(12-16)26(29)30)25-11-10-22-13-25/h4-14H,3H2,1-2H3,(H,23,28)(H,24,27)