[3-ethynyl-5-(4-methoxypiperidin-1-yl)-2-nitro-phenyl]carbamic acid

Systemtic Name: [3-ethynyl-5-(4-methoxypiperidin-1-yl)-2-nitro-phenyl]carbamic acid Openeye Name: [3-ethynyl-5-(4-methoxy-1-piperidyl)-2-nitro-phenyl]carbamic acid CAS Name: [3-ethynyl-5-(4-methoxy-1-piperidinyl)-2-nitrophenyl]carbamic acid IUPAC Name: [3-ethynyl-5-(4-methoxypiperidin-1-yl)-2-nitrophenyl]carbamic acid Traditional Name: [3-ethynyl-5-(4-methoxypiperidino)-2-nitro-phenyl]carbamic acid Formula: C15H17N3O5 MolecularWeight: 319.31258

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Descriptors Computed from Structure

Canonical SMILES:

COC1CCN(CC1)C2=CC(=C(C(=C2)C#C)[N+](=O)[O-])NC(=O)O

Isomeric SMILES

COC1CCN(CC1)C2=CC(=C(C(=C2)C#C)[N+](=O)[O-])NC(=O)O

InChI

InChI=1S/C15H17N3O5/c1-3-10-8-11(17-6-4-12(23-2)5-7-17)9-13(16-15(19)20)14(10)18(21)22/h1,8-9,12,16H,4-7H2,2H3,(H,19,20)