2-(5-nitro-6-piperidin-1-yl-pyrimidin-4-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indole

Systemtic Name: 2-(5-nitro-6-piperidin-1-yl-pyrimidin-4-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indole Openeye Name: 2-[5-nitro-6-(1-piperidyl)pyrimidin-4-yl]-1,3,4,9-tetrahydropyrido[3,4-b]indole CAS Name: 2-[5-nitro-6-(1-piperidinyl)-4-pyrimidinyl]-1,3,4,9-tetrahydropyrido[3,4-b]indole IUPAC Name: 2-(5-nitro-6-piperidin-1-ylpyrimidin-4-yl)-1,3,4,9-tetrahydropyrido[3,4-b]indole Traditional Name: 2-(5-nitro-6-piperidino-pyrimidin-4-yl)-1,3,4,9-tetrahydro-$b-carboline Formula: C20H22N6O2 MolecularWeight: 378.42768

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCC4=C(C3)NC5=CC=CC=C45

Isomeric SMILES

C1CCN(CC1)C2=NC=NC(=C2[N+](=O)[O-])N3CCC4=C(C3)NC5=CC=CC=C45

InChI

InChI=1S/C20H22N6O2/c27-26(28)18-19(24-9-4-1-5-10-24)21-13-22-20(18)25-11-8-15-14-6-2-3-7-16(14)23-17(15)12-25/h2-3,6-7,13,23H,1,4-5,8-12H2