ethyl 4-[2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]piperidine-1-carboxylate

Systemtic Name: ethyl 4-[2-(6-nitro-3-oxidanylidene-1,4-benzoxazin-4-yl)ethanoylamino]piperidine-1-carboxylate Openeye Name: ethyl 4-[[2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]piperidine-1-carboxylate CAS Name: 4-[[2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)-1-oxoethyl]amino]-1-piperidinecarboxylic acid ethyl ester IUPAC Name: ethyl 4-[[2-(6-nitro-3-oxo-1,4-benzoxazin-4-yl)acetyl]amino]piperidine-1-carboxylate Traditional Name: 4-[[2-(3-keto-6-nitro-1,4-benzoxazin-4-yl)acetyl]amino]piperidine-1-carboxylic acid ethyl ester Formula: C18H22N4O7 MolecularWeight: 406.38988

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)N1CCC(CC1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

Isomeric SMILES

CCOC(=O)N1CCC(CC1)NC(=O)CN2C(=O)COC3=C2C=C(C=C3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N4O7/c1-2-28-18(25)20-7-5-12(6-8-20)19-16(23)10-21-14-9-13(22(26)27)3-4-15(14)29-11-17(21)24/h3-4,9,12H,2,5-8,10-11H2,1H3,(H,19,23)