4-[6-[4-(benzotriazol-1-yl)piperidin-1-yl]-5-nitro-pyrimidin-4-yl]morpholine

Systemtic Name: 4-[6-[4-(benzotriazol-1-yl)piperidin-1-yl]-5-nitro-pyrimidin-4-yl]morpholine Openeye Name: 4-[6-[4-(benzotriazol-1-yl)-1-piperidyl]-5-nitro-pyrimidin-4-yl]morpholine CAS Name: 4-[6-[4-(1-benzotriazolyl)-1-piperidinyl]-5-nitro-4-pyrimidinyl]morpholine IUPAC Name: 4-[6-[4-(benzotriazol-1-yl)piperidin-1-yl]-5-nitropyrimidin-4-yl]morpholine Traditional Name: 4-[6-[4-(benzotriazol-1-yl)piperidino]-5-nitro-pyrimidin-4-yl]morpholine Formula: C19H22N8O3 MolecularWeight: 410.42978

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3N=N2)C4=C(C(=NC=N4)N5CCOCC5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3N=N2)C4=C(C(=NC=N4)N5CCOCC5)[N+](=O)[O-]

InChI

InChI=1S/C19H22N8O3/c28-27(29)17-18(20-13-21-19(17)25-9-11-30-12-10-25)24-7-5-14(6-8-24)26-16-4-2-1-3-15(16)22-23-26/h1-4,13-14H,5-12H2