3-[[7-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]phenol

Systemtic Name: 3-[[7-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]phenol Openeye Name: 3-[[7-(4-methyl-1-piperidyl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]phenol CAS Name: 3-[[7-(4-methyl-1-piperidinyl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]phenol IUPAC Name: 3-[[7-(4-methylpiperidin-1-yl)-4-nitro-2,1,3-benzoxadiazol-5-yl]amino]phenol Traditional Name: 3-[[7-(4-methylpiperidino)-4-nitro-benzofurazan-5-yl]amino]phenol Formula: C18H19N5O4 MolecularWeight: 369.37456

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Descriptors Computed from Structure

Canonical SMILES:

CC1CCN(CC1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NC4=CC(=CC=C4)O

Isomeric SMILES

CC1CCN(CC1)C2=CC(=C(C3=NON=C23)[N+](=O)[O-])NC4=CC(=CC=C4)O

InChI

InChI=1S/C18H19N5O4/c1-11-5-7-22(8-6-11)15-10-14(19-12-3-2-4-13(24)9-12)18(23(25)26)17-16(15)20-27-21-17/h2-4,9-11,19,24H,5-8H2,1H3