2-(1,3-benzodioxol-5-yl)-4-[(3,8-dimethyl-5-propan-2-yl-azulen-1-yl)methylidene]-1,3-oxazol-5-one

Systemtic Name: 2-(1,3-benzodioxol-5-yl)-4-[(3,8-dimethyl-5-propan-2-yl-azulen-1-yl)methylidene]-1,3-oxazol-5-one Openeye Name: 2-(1,3-benzodioxol-5-yl)-4-[(5-isopropyl-3,8-dimethyl-azulen-1-yl)methylene]oxazol-5-one CAS Name: 2-(1,3-benzodioxol-5-yl)-4-[(3,8-dimethyl-5-propan-2-yl-1-azulenyl)methylidene]-5-oxazolone IUPAC Name: 2-(1,3-benzodioxol-5-yl)-4-[(3,8-dimethyl-5-propan-2-ylazulen-1-yl)methylidene]-1,3-oxazol-5-one Traditional Name: 2-(1,3-benzodioxol-5-yl)-4-[(5-isopropyl-3,8-dimethyl-azulen-1-yl)methylene]-2-oxazolin-5-one Formula: C26H23NO4 MolecularWeight: 413.46512

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C)C=C3C(=O)OC(=N3)C4=CC5=C(C=C4)OCO5

Isomeric SMILES

CC1=C2C(=CC(=C2C=C(C=C1)C(C)C)C)C=C3C(=O)OC(=N3)C4=CC5=C(C=C4)OCO5

InChI

InChI=1S/C26H23NO4/c1-14(2)17-6-5-15(3)24-19(9-16(4)20(24)10-17)11-21-26(28)31-25(27-21)18-7-8-22-23(12-18)30-13-29-22/h5-12,14H,13H2,1-4H3