N-[2-(1-adamantyloxy)ethyl]-8-methoxy-6-nitro-2-oxidanylidene-chromene-3-carboxamide

Systemtic Name: N-[2-(1-adamantyloxy)ethyl]-8-methoxy-6-nitro-2-oxidanylidene-chromene-3-carboxamide Openeye Name: N-[2-(1-adamantyloxy)ethyl]-8-methoxy-6-nitro-2-oxo-chromene-3-carboxamide CAS Name: N-[2-(1-adamantyloxy)ethyl]-8-methoxy-6-nitro-2-oxo-1-benzopyran-3-carboxamide IUPAC Name: N-[2-(1-adamantyloxy)ethyl]-8-methoxy-6-nitro-2-oxochromene-3-carboxamide Traditional Name: N-[2-(1-adamantyloxy)ethyl]-2-keto-8-methoxy-6-nitro-chromene-3-carboxamide Formula: C23H26N2O7 MolecularWeight: 442.46174

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C2C(=CC(=C1)[N+](=O)[O-])C=C(C(=O)O2)C(=O)NCCOC34CC5CC(C3)CC(C5)C4

Isomeric SMILES

COC1=C2C(=CC(=C1)[N+](=O)[O-])C=C(C(=O)O2)C(=O)NCCOC34CC5CC(C3)CC(C5)C4

InChI

InChI=1S/C23H26N2O7/c1-30-19-9-17(25(28)29)7-16-8-18(22(27)32-20(16)19)21(26)24-2-3-31-23-10-13-4-14(11-23)6-15(5-13)12-23/h7-9,13-15H,2-6,10-12H2,1H3,(H,24,26)