3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-(phenylmethyl)benzamide

Systemtic Name: 3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]-N-(phenylmethyl)benzamide Openeye Name: N-benzyl-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]benzamide CAS Name: 3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]-N-(phenylmethyl)benzamide IUPAC Name: N-benzyl-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]benzamide Traditional Name: N-benzyl-4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-3-nitro-benzamide Formula: C27H26N4O5 MolecularWeight: 486.51914

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3COC2=O)C4=C(C=C(C=C4)C(=O)NCC5=CC=CC=C5)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3COC2=O)C4=C(C=C(C=C4)C(=O)NCC5=CC=CC=C5)[N+](=O)[O-]

InChI

InChI=1S/C27H26N4O5/c32-26(28-17-19-6-2-1-3-7-19)20-10-11-24(25(16-20)31(34)35)29-14-12-22(13-15-29)30-23-9-5-4-8-21(23)18-36-27(30)33/h1-11,16,22H,12-15,17-18H2,(H,28,32)