4-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide

Systemtic Name: 4-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Openeye Name: 4-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide CAS Name: 4-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide IUPAC Name: 4-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Traditional Name: 4-nitro-N-[1-[4-(1,2,4-triazol-1-yl)phenyl]ethyl]benzamide Formula: C17H15N5O3 MolecularWeight: 337.3327

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CC(C1=CC=C(C=C1)N2C=NC=N2)NC(=O)C3=CC=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C17H15N5O3/c1-12(13-2-6-15(7-3-13)21-11-18-10-19-21)20-17(23)14-4-8-16(9-5-14)22(24)25/h2-12H,1H3,(H,20,23)