N-(1-adamantyl)-1-methyl-4-nitro-pyrrole-2-carboxamide

Systemtic Name: N-(1-adamantyl)-1-methyl-4-nitro-pyrrole-2-carboxamide Openeye Name: N-(1-adamantyl)-1-methyl-4-nitro-pyrrole-2-carboxamide CAS Name: N-(1-adamantyl)-1-methyl-4-nitro-2-pyrrolecarboxamide IUPAC Name: N-(1-adamantyl)-1-methyl-4-nitropyrrole-2-carboxamide Traditional Name: N-(1-adamantyl)-1-methyl-4-nitro-pyrrole-2-carboxamide Formula: C16H21N3O3 MolecularWeight: 303.35624

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Descriptors Computed from Structure

Canonical SMILES:

CN1C=C(C=C1C(=O)NC23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

Isomeric SMILES

CN1C=C(C=C1C(=O)NC23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

InChI

InChI=1S/C16H21N3O3/c1-18-9-13(19(21)22)5-14(18)15(20)17-16-6-10-2-11(7-16)4-12(3-10)8-16/h5,9-12H,2-4,6-8H2,1H3,(H,17,20)