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

Systemtic Name: 3-[[4-(3-nitrophenyl)piperazin-1-yl]methyl]quinazolin-4-one Openeye Name: 3-[[4-(3-nitrophenyl)piperazin-1-yl]methyl]quinazolin-4-one CAS Name: 3-[[4-(3-nitrophenyl)-1-piperazinyl]methyl]-4-quinazolinone IUPAC Name: 3-[[4-(3-nitrophenyl)piperazin-1-yl]methyl]quinazolin-4-one Traditional Name: 3-[[4-(3-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(=CC=C4)[N+](=O)[O-]

Isomeric SMILES

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

InChI

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