N-[(E)-(5-nitrothiophen-3-yl)methylideneamino]adamantane-1-carboxamide

Systemtic Name: N-[(E)-(5-nitrothiophen-3-yl)methylideneamino]adamantane-1-carboxamide Openeye Name: N-[(E)-(5-nitro-3-thienyl)methyleneamino]adamantane-1-carboxamide CAS Name: N-[(E)-(5-nitro-3-thiophenyl)methylideneamino]-1-adamantanecarboxamide IUPAC Name: N-[(E)-(5-nitrothiophen-3-yl)methylideneamino]adamantane-1-carboxamide Traditional Name: N-[(E)-(5-nitro-3-thienyl)methyleneamino]adamantane-1-carboxamide Formula: C16H19N3O3S MolecularWeight: 333.40536

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Descriptors Computed from Structure

Canonical SMILES:

C1C2CC3CC1CC(C2)(C3)C(=O)NN=CC4=CSC(=C4)[N+](=O)[O-]

Isomeric SMILES

C1C2CC3CC1CC(C2)(C3)C(=O)N/N=C/C4=CSC(=C4)[N+](=O)[O-]

InChI

InChI=1S/C16H19N3O3S/c20-15(18-17-8-13-4-14(19(21)22)23-9-13)16-5-10-1-11(6-16)3-12(2-10)7-16/h4,8-12H,1-3,5-7H2,(H,18,20)/b17-8+