methanolate; [7-methyl-8-(4-methylpent-3-enyl)-1-oxidanylidene-3-propan-2-yl-naphthalen-2-ylidene]oxidanium

Systemtic Name: methanolate; [7-methyl-8-(4-methylpent-3-enyl)-1-oxidanylidene-3-propan-2-yl-naphthalen-2-ylidene]oxidanium Openeye Name: [3-isopropyl-7-methyl-8-(4-methylpent-3-enyl)-1-oxo-2-naphthylidene]oxonium; methanolate CAS Name: methanolate; [7-methyl-8-(4-methylpent-3-enyl)-1-oxo-3-propan-2-yl-2-naphthalenylidene]oxonium IUPAC Name: methanolate; [7-methyl-8-(4-methylpent-3-enyl)-1-oxo-3-propan-2-ylnaphthalen-2-ylidene]oxidanium Traditional Name: [3-isopropyl-1-keto-7-methyl-8-(4-methylpent-3-enyl)-2-naphthylidene]oxonium; methanolate Formula: C21H28O3 MolecularWeight: 328.44522

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C2=C(C=C1)C=C(C(=[OH+])C2=O)C(C)C)CCC=C(C)C.C[O-]

Isomeric SMILES

CC1=C(C2=C(C=C1)C=C(C(=[OH+])C2=O)C(C)C)CCC=C(C)C.C[O-]

InChI

InChI=1S/C20H24O2.CH3O/c1-12(2)7-6-8-16-14(5)9-10-15-11-17(13(3)4)19(21)20(22)18(15)16;1-2/h7,9-11,13H,6,8H2,1-5H3;1H3/q;-1/p+1