N-[(2,5-dimethoxyphenyl)methyl]-2-methyl-5-nitro-N-prop-2-enyl-1,2,4-triazol-3-amine

Systemtic Name: N-[(2,5-dimethoxyphenyl)methyl]-2-methyl-5-nitro-N-prop-2-enyl-1,2,4-triazol-3-amine Openeye Name: N-allyl-N-[(2,5-dimethoxyphenyl)methyl]-2-methyl-5-nitro-1,2,4-triazol-3-amine CAS Name: N-[(2,5-dimethoxyphenyl)methyl]-2-methyl-5-nitro-N-prop-2-enyl-1,2,4-triazol-3-amine IUPAC Name: N-[(2,5-dimethoxyphenyl)methyl]-2-methyl-5-nitro-N-prop-2-enyl-1,2,4-triazol-3-amine Traditional Name: allyl-(2,5-dimethoxybenzyl)-(2-methyl-5-nitro-1,2,4-triazol-3-yl)amine Formula: C15H19N5O4 MolecularWeight: 333.34246

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Descriptors Computed from Structure

Canonical SMILES:

CN1C(=NC(=N1)[N+](=O)[O-])N(CC=C)CC2=C(C=CC(=C2)OC)OC

Isomeric SMILES

CN1C(=NC(=N1)[N+](=O)[O-])N(CC=C)CC2=C(C=CC(=C2)OC)OC

InChI

InChI=1S/C15H19N5O4/c1-5-8-19(15-16-14(20(21)22)17-18(15)2)10-11-9-12(23-3)6-7-13(11)24-4/h5-7,9H,1,8,10H2,2-4H3