2-[[7-[(2,5-dimethoxyphenyl)methyl-prop-2-enyl-amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol

Systemtic Name: 2-[[7-[(2,5-dimethoxyphenyl)methyl-prop-2-enyl-amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol Openeye Name: 2-[[7-[allyl-[(2,5-dimethoxyphenyl)methyl]amino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol CAS Name: 2-[[7-[(2,5-dimethoxyphenyl)methyl-prop-2-enylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol IUPAC Name: 2-[[7-[(2,5-dimethoxyphenyl)methyl-prop-2-enylamino]-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]ethanol Traditional Name: 2-[[7-[allyl-(2,5-dimethoxybenzyl)amino]-4-nitro-benzofurazan-5-yl]amino]ethanol Formula: C20H23N5O6 MolecularWeight: 429.42652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC(=C(C=C1)OC)CN(CC=C)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCO

Isomeric SMILES

COC1=CC(=C(C=C1)OC)CN(CC=C)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NCCO

InChI

InChI=1S/C20H23N5O6/c1-4-8-24(12-13-10-14(29-2)5-6-17(13)30-3)16-11-15(21-7-9-26)20(25(27)28)19-18(16)22-31-23-19/h4-6,10-11,21,26H,1,7-9,12H2,2-3H3