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

Systemtic Name: N-(1-adamantyl)-3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]benzamide Openeye Name: N-(1-adamantyl)-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]benzamide CAS Name: N-(1-adamantyl)-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]benzamide IUPAC Name: N-(1-adamantyl)-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]benzamide Traditional Name: N-(1-adamantyl)-4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-3-nitro-benzamide Formula: C30H34N4O5 MolecularWeight: 530.61476

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Descriptors Computed from Structure

Canonical SMILES:

C1CN(CCC1N2C3=CC=CC=C3COC2=O)C4=C(C=C(C=C4)C(=O)NC56CC7CC(C5)CC(C7)C6)[N+](=O)[O-]

Isomeric SMILES

C1CN(CCC1N2C3=CC=CC=C3COC2=O)C4=C(C=C(C=C4)C(=O)NC56CC7CC(C5)CC(C7)C6)[N+](=O)[O-]

InChI

InChI=1S/C30H34N4O5/c35-28(31-30-15-19-11-20(16-30)13-21(12-19)17-30)22-5-6-26(27(14-22)34(37)38)32-9-7-24(8-10-32)33-25-4-2-1-3-23(25)18-39-29(33)36/h1-6,14,19-21,24H,7-13,15-18H2,(H,31,35)