2-[[4-(3-nitropyridin-2-yl)piperazin-1-yl]methyl]quinazolin-4-amine

Systemtic Name: 2-[[4-(3-nitropyridin-2-yl)piperazin-1-yl]methyl]quinazolin-4-amine Openeye Name: 2-[[4-(3-nitro-2-pyridyl)piperazin-1-yl]methyl]quinazolin-4-amine CAS Name: 2-[[4-(3-nitro-2-pyridinyl)-1-piperazinyl]methyl]-4-quinazolinamine IUPAC Name: 2-[[4-(3-nitropyridin-2-yl)piperazin-1-yl]methyl]quinazolin-4-amine Traditional Name: [2-[[4-(3-nitro-2-pyridyl)piperazino]methyl]quinazolin-4-yl]amine Formula: C18H19N7O2 MolecularWeight: 365.38916

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C4=C(C=CC=N4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CC2=NC3=CC=CC=C3C(=N2)N)C4=C(C=CC=N4)[N+](=O)[O-]

InChI

InChI=1S/C18H19N7O2/c19-17-13-4-1-2-5-14(13)21-16(22-17)12-23-8-10-24(11-9-23)18-15(25(26)27)6-3-7-20-18/h1-7H,8-12H2,(H2,19,21,22)