1-[1-[2-nitro-4-(phenylcarbonyl)phenyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one

Systemtic Name: 1-[1-[2-nitro-4-(phenylcarbonyl)phenyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-(4-benzoyl-2-nitro-phenyl)-4-piperidyl]-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-(4-benzoyl-2-nitrophenyl)-4-piperidinyl]-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-(4-benzoyl-2-nitrophenyl)piperidin-4-yl]-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-(4-benzoyl-2-nitro-phenyl)-4-piperidyl]-4H-3,1-benzoxazin-2-one Formula: C26H23N3O5 MolecularWeight: 457.47792

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3COC2=O)C4=C(C=C(C=C4)C(=O)C5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3COC2=O)C4=C(C=C(C=C4)C(=O)C5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C26H23N3O5/c30-25(18-6-2-1-3-7-18)19-10-11-23(24(16-19)29(32)33)27-14-12-21(13-15-27)28-22-9-5-4-8-20(22)17-34-26(28)31/h1-11,16,21H,12-15,17H2