N-(3-methoxypropyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(3-methoxypropyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(3-methoxypropyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(3-methoxypropyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(3-methoxypropyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(3-methoxypropyl)-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C13H15N5O4 MolecularWeight: 305.2893

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C13H15N5O4/c1-22-6-2-5-15-13(19)10-3-4-11(12(7-10)18(20)21)17-9-14-8-16-17/h3-4,7-9H,2,5-6H2,1H3,(H,15,19)