N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide

Systemtic Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Openeye Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide CAS Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide IUPAC Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Traditional Name: N-(2,3-dihydro-1,4-benzodioxin-6-ylmethyl)-N-methyl-3-nitro-4-(1,2,4-triazol-1-yl)benzamide Formula: C19H17N5O5 MolecularWeight: 395.36878

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Descriptors Computed from Structure

Canonical SMILES:

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-]

Isomeric SMILES

CN(CC1=CC2=C(C=C1)OCCO2)C(=O)C3=CC(=C(C=C3)N4C=NC=N4)[N+](=O)[O-]

InChI

InChI=1S/C19H17N5O5/c1-22(10-13-2-5-17-18(8-13)29-7-6-28-17)19(25)14-3-4-15(16(9-14)24(26)27)23-12-20-11-21-23/h2-5,8-9,11-12H,6-7,10H2,1H3