2-[2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethoxy]ethyl 4-nitrobenzoate

Systemtic Name: 2-[2-[5-methyl-2,4-bis(oxidanylidene)pyrimidin-1-yl]ethoxy]ethyl 4-nitrobenzoate Openeye Name: 2-[2-(5-methyl-2,4-dioxo-pyrimidin-1-yl)ethoxy]ethyl 4-nitrobenzoate CAS Name: 4-nitrobenzoic acid 2-[2-(5-methyl-2,4-dioxo-1-pyrimidinyl)ethoxy]ethyl ester IUPAC Name: 2-[2-(5-methyl-2,4-dioxopyrimidin-1-yl)ethoxy]ethyl 4-nitrobenzoate Traditional Name: 4-nitrobenzoic acid 2-[2-(2,4-diketo-5-methyl-pyrimidin-1-yl)ethoxy]ethyl ester Formula: C16H17N3O7 MolecularWeight: 363.32208

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CN(C(=O)NC1=O)CCOCCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

Isomeric SMILES

CC1=CN(C(=O)NC1=O)CCOCCOC(=O)C2=CC=C(C=C2)[N+](=O)[O-]

InChI

InChI=1S/C16H17N3O7/c1-11-10-18(16(22)17-14(11)20)6-7-25-8-9-26-15(21)12-2-4-13(5-3-12)19(23)24/h2-5,10H,6-9H2,1H3,(H,17,20,22)