(6Z)-2-(1-adamantyl)-6-(methylaminomethylidene)-4-nitro-cyclohexa-2,4-dien-1-one

Systemtic Name: (6Z)-2-(1-adamantyl)-6-(methylaminomethylidene)-4-nitro-cyclohexa-2,4-dien-1-one Openeye Name: (6Z)-2-(1-adamantyl)-6-(methylaminomethylene)-4-nitro-cyclohexa-2,4-dien-1-one CAS Name: (6Z)-2-(1-adamantyl)-6-(methylaminomethylidene)-4-nitro-1-cyclohexa-2,4-dienone IUPAC Name: (6Z)-2-(1-adamantyl)-6-(methylaminomethylidene)-4-nitrocyclohexa-2,4-dien-1-one Traditional Name: (6Z)-2-(1-adamantyl)-6-(methylaminomethylene)-4-nitro-cyclohexa-2,4-dien-1-one Formula: C18H22N2O3 MolecularWeight: 314.37888

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Descriptors Computed from Structure

Canonical SMILES:

CNC=C1C=C(C=C(C1=O)C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

Isomeric SMILES

CN/C=C\1/C=C(C=C(C1=O)C23CC4CC(C2)CC(C4)C3)[N+](=O)[O-]

InChI

InChI=1S/C18H22N2O3/c1-19-10-14-5-15(20(22)23)6-16(17(14)21)18-7-11-2-12(8-18)4-13(3-11)9-18/h5-6,10-13,19H,2-4,7-9H2,1H3/b14-10-