3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinazolin-4-one

Systemtic Name: 3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinazolin-4-one Openeye Name: 3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinazolin-4-one CAS Name: 3-[[4-(4-nitrophenyl)-1-piperazinyl]methyl]-4-quinazolinone IUPAC Name: 3-[[4-(4-nitrophenyl)piperazin-1-yl]methyl]quinazolin-4-one Traditional Name: 3-[[4-(4-nitrophenyl)piperazino]methyl]quinazolin-4-one Formula: C19H19N5O3 MolecularWeight: 365.38586

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCN1CN2C=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCN1CN2C=NC3=CC=CC=C3C2=O)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C19H19N5O3/c25-19-17-3-1-2-4-18(17)20-13-23(19)14-21-9-11-22(12-10-21)15-5-7-16(8-6-15)24(26)27/h1-8,13H,9-12,14H2