2-[(1R)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethyl]-1H-quinazolin-4-one

Systemtic Name: 2-[(1R)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethyl]-1H-quinazolin-4-one Openeye Name: 2-[(1R)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethyl]-1H-quinazolin-4-one CAS Name: 2-[(1R)-1-[4-(4-nitrophenyl)-1-piperazinyl]ethyl]-1H-quinazolin-4-one IUPAC Name: 2-[(1R)-1-[4-(4-nitrophenyl)piperazin-1-yl]ethyl]-1H-quinazolin-4-one Traditional Name: 2-[(1R)-1-[4-(4-nitrophenyl)piperazino]ethyl]-1H-quinazolin-4-one Formula: C20H21N5O3 MolecularWeight: 379.41244

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Descriptors Computed from Structure

Canonical SMILES:

CC(C1=NC(=O)C2=CC=CC=C2N1)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

Isomeric SMILES

C[C@H](C1=NC(=O)C2=CC=CC=C2N1)N3CCN(CC3)C4=CC=C(C=C4)[N+](=O)[O-]

InChI

InChI=1S/C20H21N5O3/c1-14(19-21-18-5-3-2-4-17(18)20(26)22-19)23-10-12-24(13-11-23)15-6-8-16(9-7-15)25(27)28/h2-9,14H,10-13H2,1H3,(H,21,22,26)/t14-/m1/s1