N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]-5-nitro-benzamide

Systemtic Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-methyl-1,3-bis(oxidanyl)propan-2-yl]amino]-5-nitro-benzamide Openeye Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[[2-hydroxy-1-(hydroxymethyl)-1-methyl-ethyl]amino]-5-nitro-benzamide CAS Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(1,3-dihydroxy-2-methylpropan-2-yl)amino]-5-nitrobenzamide IUPAC Name: N-(1,3-benzodioxol-5-ylmethyl)-2-[(1,3-dihydroxy-2-methylpropan-2-yl)amino]-5-nitrobenzamide Traditional Name: 2-[(2-hydroxy-1-methyl-1-methylol-ethyl)amino]-5-nitro-N-piperonyl-benzamide Formula: C19H21N3O7 MolecularWeight: 403.38594

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Descriptors Computed from Structure

Canonical SMILES:

CC(CO)(CO)NC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCC2=CC3=C(C=C2)OCO3

Isomeric SMILES

CC(CO)(CO)NC1=C(C=C(C=C1)[N+](=O)[O-])C(=O)NCC2=CC3=C(C=C2)OCO3

InChI

InChI=1S/C19H21N3O7/c1-19(9-23,10-24)21-15-4-3-13(22(26)27)7-14(15)18(25)20-8-12-2-5-16-17(6-12)29-11-28-16/h2-7,21,23-24H,8-11H2,1H3,(H,20,25)