propyl 4-[[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]carbonylamino]benzoate

Systemtic Name: propyl 4-[[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]carbonylamino]benzoate Openeye Name: propyl 4-[[3-nitro-4-(1,2,4-triazol-1-yl)benzoyl]amino]benzoate CAS Name: 4-[[[3-nitro-4-(1,2,4-triazol-1-yl)phenyl]-oxomethyl]amino]benzoic acid propyl ester IUPAC Name: propyl 4-[[3-nitro-4-(1,2,4-triazol-1-yl)benzoyl]amino]benzoate Traditional Name: 4-[[3-nitro-4-(1,2,4-triazol-1-yl)benzoyl]amino]benzoic acid propyl ester Formula: C19H17N5O5 MolecularWeight: 395.36878

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Descriptors Computed from Structure

Canonical SMILES:

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

Isomeric SMILES

CCCOC(=O)C1=CC=C(C=C1)NC(=O)C2=CC(=C(C=C2)N3C=NC=N3)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O5/c1-2-9-29-19(26)13-3-6-15(7-4-13)22-18(25)14-5-8-16(17(10-14)24(27)28)23-12-20-11-21-23/h3-8,10-12H,2,9H2,1H3,(H,22,25)