(E)-tert-butyl-[(3-ethanoyl-4-methyl-7-propan-2-yl-azulen-1-yl)methylidene]-oxidanyl-azanium

Systemtic Name: (E)-tert-butyl-[(3-ethanoyl-4-methyl-7-propan-2-yl-azulen-1-yl)methylidene]-oxidanyl-azanium Openeye Name: (E)-(3-acetyl-7-isopropyl-4-methyl-azulen-1-yl)methylene-tert-butyl-hydroxy-ammonium CAS Name: (E)-(3-acetyl-4-methyl-7-propan-2-yl-1-azulenyl)methylidene-tert-butyl-hydroxyammonium IUPAC Name: (E)-(3-acetyl-4-methyl-7-propan-2-ylazulen-1-yl)methylidene-tert-butyl-hydroxyazanium Traditional Name: (E)-(3-acetyl-7-isopropyl-4-methyl-azulen-1-yl)methylene-tert-butyl-hydroxy-ammonium Formula: C21H28NO2+ MolecularWeight: 326.45252

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C=[N+](C(C)(C)C)O)C(=O)C

Isomeric SMILES

CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)/C=[N+](\C(C)(C)C)/O)C(=O)C

InChI

InChI=1S/C21H28NO2/c1-13(2)16-9-8-14(3)20-18(15(4)23)11-17(19(20)10-16)12-22(24)21(5,6)7/h8-13,24H,1-7H3/q+1/b22-12+