N-[4-(furan-2-yl)butan-2-yl]-N-methyl-5-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine

Systemtic Name: N-[4-(furan-2-yl)butan-2-yl]-N-methyl-5-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine Openeye Name: N-[3-(2-furyl)-1-methyl-propyl]-N-methyl-5-(4-methyl-1-piperidyl)-4-nitro-2,1,3-benzoxadiazol-7-amine CAS Name: N-[4-(2-furanyl)butan-2-yl]-N-methyl-5-(4-methyl-1-piperidinyl)-4-nitro-2,1,3-benzoxadiazol-7-amine IUPAC Name: N-[4-(furan-2-yl)butan-2-yl]-N-methyl-5-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-7-amine Traditional Name: [3-(2-furyl)-1-methyl-propyl]-methyl-[6-(4-methylpiperidino)-7-nitro-benzofurazan-4-yl]amine Formula: C21H27N5O4 MolecularWeight: 413.47018

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=C(C3=NON=C3C(=C2)N(C)C(C)CCC4=CC=CO4)[N+](=O)[O-]

Isomeric SMILES

CC1CCN(CC1)C2=C(C3=NON=C3C(=C2)N(C)C(C)CCC4=CC=CO4)[N+](=O)[O-]

InChI

InChI=1S/C21H27N5O4/c1-14-8-10-25(11-9-14)18-13-17(19-20(23-30-22-19)21(18)26(27)28)24(3)15(2)6-7-16-5-4-12-29-16/h4-5,12-15H,6-11H2,1-3H3