3-[2-[4-[(4-nitrophenyl)amino]-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazinyl]indol-2-one

Systemtic Name: 3-[2-[4-[(4-nitrophenyl)amino]-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazinyl]indol-2-one Openeye Name: 3-[2-[4-(4-nitroanilino)-6-(1-piperidyl)-1,3,5-triazin-2-yl]hydrazino]indol-2-one CAS Name: 3-[[4-(4-nitroanilino)-6-(1-piperidinyl)-1,3,5-triazin-2-yl]hydrazo]-2-indolone IUPAC Name: 3-[2-[4-(4-nitroanilino)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazinyl]indol-2-one Traditional Name: 3-[N'-[4-(4-nitroanilino)-6-piperidino-s-triazin-2-yl]hydrazino]indol-2-one Formula: C22H21N9O3 MolecularWeight: 459.46064

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(CC1)C2=NC(=NC(=N2)NNC3=C4C=CC=CC4=NC3=O)NC5=CC=C(C=C5)[N+](=O)[O-]

Isomeric SMILES

C1CCN(CC1)C2=NC(=NC(=N2)NNC3=C4C=CC=CC4=NC3=O)NC5=CC=C(C=C5)[N+](=O)[O-]

InChI

InChI=1S/C22H21N9O3/c32-19-18(16-6-2-3-7-17(16)24-19)28-29-21-25-20(23-14-8-10-15(11-9-14)31(33)34)26-22(27-21)30-12-4-1-5-13-30/h2-3,6-11H,1,4-5,12-13H2,(H,24,28,32)(H2,23,25,26,27,29)