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

Systemtic Name: 1-[1-[4-[2-(hydroxymethyl)piperidin-1-yl]carbonyl-2-nitro-phenyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one Openeye Name: 1-[1-[4-[2-(hydroxymethyl)piperidine-1-carbonyl]-2-nitro-phenyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one CAS Name: 1-[1-[4-[[2-(hydroxymethyl)-1-piperidinyl]-oxomethyl]-2-nitrophenyl]-4-piperidinyl]-4H-3,1-benzoxazin-2-one IUPAC Name: 1-[1-[4-[2-(hydroxymethyl)piperidine-1-carbonyl]-2-nitrophenyl]piperidin-4-yl]-4H-3,1-benzoxazin-2-one Traditional Name: 1-[1-[4-(2-methylolpiperidine-1-carbonyl)-2-nitro-phenyl]-4-piperidyl]-4H-3,1-benzoxazin-2-one Formula: C26H30N4O6 MolecularWeight: 494.5396

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Descriptors Computed from Structure

Canonical SMILES:

C1CCN(C(C1)CO)C(=O)C2=CC(=C(C=C2)N3CCC(CC3)N4C5=CC=CC=C5COC4=O)[N+](=O)[O-]

Isomeric SMILES

C1CCN(C(C1)CO)C(=O)C2=CC(=C(C=C2)N3CCC(CC3)N4C5=CC=CC=C5COC4=O)[N+](=O)[O-]

InChI

InChI=1S/C26H30N4O6/c31-16-21-6-3-4-12-28(21)25(32)18-8-9-23(24(15-18)30(34)35)27-13-10-20(11-14-27)29-22-7-2-1-5-19(22)17-36-26(29)33/h1-2,5,7-9,15,20-21,31H,3-4,6,10-14,16-17H2