methyl 2-[[3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]phenyl]carbonylamino]propanoate

Systemtic Name: methyl 2-[[3-nitro-4-[4-(2-oxidanylidene-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]phenyl]carbonylamino]propanoate Openeye Name: methyl 2-[[3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidyl]benzoyl]amino]propanoate CAS Name: 2-[[[3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)-1-piperidinyl]phenyl]-oxomethyl]amino]propanoic acid methyl ester IUPAC Name: methyl 2-[[3-nitro-4-[4-(2-oxo-4H-3,1-benzoxazin-1-yl)piperidin-1-yl]benzoyl]amino]propanoate Traditional Name: 2-[[4-[4-(2-keto-4H-3,1-benzoxazin-1-yl)piperidino]-3-nitro-benzoyl]amino]propionic acid methyl ester Formula: C24H26N4O7 MolecularWeight: 482.48584

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C(=O)OC)NC(=O)C1=CC(=C(C=C1)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)[N+](=O)[O-]

Isomeric SMILES

CC(C(=O)OC)NC(=O)C1=CC(=C(C=C1)N2CCC(CC2)N3C4=CC=CC=C4COC3=O)[N+](=O)[O-]

InChI

InChI=1S/C24H26N4O7/c1-15(23(30)34-2)25-22(29)16-7-8-20(21(13-16)28(32)33)26-11-9-18(10-12-26)27-19-6-4-3-5-17(19)14-35-24(27)31/h3-8,13,15,18H,9-12,14H2,1-2H3,(H,25,29)