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

Systemtic Name: N,N-bis(cyanomethyl)-3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]benzamide Openeye Name: N,N-bis(cyanomethyl)-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]benzamide CAS Name: N,N-bis(cyanomethyl)-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]benzamide IUPAC Name: N,N-bis(cyanomethyl)-3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]benzamide Traditional Name: N,N-bis(cyanomethyl)-4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-3-nitro-benzamide Formula: C24H22N6O5 MolecularWeight: 474.46868

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/C24H22N6O5/c25-9-13-28(14-10-26)23(31)17-5-6-21(22(15-17)30(33)34)27-11-7-19(8-12-27)29-20-4-2-1-3-18(20)16-35-24(29)32/h1-6,15,19H,7-8,11-14,16H2