N-[(Z)-1-(5-nitrothiophen-2-yl)ethylideneamino]adamantane-1-carboxamide

Systemtic Name: N-[(Z)-1-(5-nitrothiophen-2-yl)ethylideneamino]adamantane-1-carboxamide Openeye Name: N-[(Z)-1-(5-nitro-2-thienyl)ethylideneamino]adamantane-1-carboxamide CAS Name: N-[(Z)-1-(5-nitro-2-thiophenyl)ethylideneamino]-1-adamantanecarboxamide IUPAC Name: N-[(Z)-1-(5-nitrothiophen-2-yl)ethylideneamino]adamantane-1-carboxamide Traditional Name: N-[(Z)-1-(5-nitro-2-thienyl)ethylideneamino]adamantane-1-carboxamide Formula: C17H21N3O3S MolecularWeight: 347.43194

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Descriptors Computed from Structure

Canonical SMILES:

CC(=NNC(=O)C12CC3CC(C1)CC(C3)C2)C4=CC=C(S4)[N+](=O)[O-]

Isomeric SMILES

C/C(=N/NC(=O)C12CC3CC(C1)CC(C3)C2)/C4=CC=C(S4)[N+](=O)[O-]

InChI

InChI=1S/C17H21N3O3S/c1-10(14-2-3-15(24-14)20(22)23)18-19-16(21)17-7-11-4-12(8-17)6-13(5-11)9-17/h2-3,11-13H,4-9H2,1H3,(H,19,21)/b18-10-