N-[(2,3-dimethoxyphenyl)methyl]-4-nitro-N-prop-2-enyl-2,1,3-benzoxadiazol-7-amine

Systemtic Name: N-[(2,3-dimethoxyphenyl)methyl]-4-nitro-N-prop-2-enyl-2,1,3-benzoxadiazol-7-amine Openeye Name: N-allyl-N-[(2,3-dimethoxyphenyl)methyl]-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: N-[(2,3-dimethoxyphenyl)methyl]-4-nitro-N-prop-2-enyl-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-[(2,3-dimethoxyphenyl)methyl]-4-nitro-N-prop-2-enyl-2,1,3-benzoxadiazol-7-amine Traditional Name: allyl-(7-nitrobenzofurazan-4-yl)-o-veratryl-amine Formula: C18H18N4O5 MolecularWeight: 370.35932

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=CC(=C1OC)CN(CC=C)C2=CC=C(C3=NON=C23)[N+](=O)[O-]

Isomeric SMILES

COC1=CC=CC(=C1OC)CN(CC=C)C2=CC=C(C3=NON=C23)[N+](=O)[O-]

InChI

InChI=1S/C18H18N4O5/c1-4-10-21(11-12-6-5-7-15(25-2)18(12)26-3)13-8-9-14(22(23)24)17-16(13)19-27-20-17/h4-9H,1,10-11H2,2-3H3