N-tert-butyl-1-(3-carboxy-4-methyl-7-propan-2-yl-azulen-1-yl)methanimine oxide

Systemtic Name: N-tert-butyl-1-(3-carboxy-4-methyl-7-propan-2-yl-azulen-1-yl)methanimine oxide Openeye Name: N-tert-butyl-1-(3-carboxy-7-isopropyl-4-methyl-azulen-1-yl)methanimine oxide CAS Name: N-tert-butyl-1-(3-carboxy-4-methyl-7-propan-2-yl-1-azulenyl)methanimine oxide IUPAC Name: N-tert-butyl-1-(3-carboxy-4-methyl-7-propan-2-ylazulen-1-yl)methanimine oxide Traditional Name: N-tert-butyl-1-(3-carboxy-7-isopropyl-4-methyl-azulen-1-yl)methanimine oxide Formula: C20H25NO3 MolecularWeight: 327.4174

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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)O

Isomeric SMILES

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

InChI

InChI=1S/C20H25NO3/c1-12(2)14-8-7-13(3)18-16(9-14)15(10-17(18)19(22)23)11-21(24)20(4,5)6/h7-12H,1-6H3,(H,22,23)/b21-11-