carbanide; 1-(2,6-dimethyl-4-morpholin-4-ium-4-ylidene-cyclohexa-2,5-dien-1-ylidene)-2-ethyl-3-methyl-2-(phenylmethyl)butan-1-ol; zinc

Systemtic Name: carbanide; 1-(2,6-dimethyl-4-morpholin-4-ium-4-ylidene-cyclohexa-2,5-dien-1-ylidene)-2-ethyl-3-methyl-2-(phenylmethyl)butan-1-ol; zinc Openeye Name: 2-benzyl-1-(2,6-dimethyl-4-morpholin-4-ium-4-ylidene-cyclohexa-2,5-dien-1-ylidene)-2-ethyl-3-methyl-butan-1-ol; carbanide; zinc CAS Name: carbanide; 1-[2,6-dimethyl-4-(4-morpholin-4-iumylidene)-1-cyclohexa-2,5-dienylidene]-2-ethyl-3-methyl-2-(phenylmethyl)-1-butanol; zinc IUPAC Name: 2-benzyl-1-(2,6-dimethyl-4-morpholin-4-ium-4-ylidenecyclohexa-2,5-dien-1-ylidene)-2-ethyl-3-methylbutan-1-ol; carbanide; zinc Traditional Name: 2-benzyl-1-(2,6-dimethyl-4-morpholin-4-ium-4-ylidene-cyclohexa-2,5-dien-1-ylidene)-2-ethyl-3-methyl-butan-1-ol; carbanide; zinc Formula: C28H41NO2Zn-2 MolecularWeight: 489.03964

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Descriptors Computed from Structure

Canonical SMILES:

[CH3-].[CH3-].CCC(CC1=CC=CC=C1)([C-](C)C)C(=C2C(=CC(=[N+]3CCOCC3)C=C2C)C)O.[Zn]

Isomeric SMILES

[CH3-].[CH3-].CCC(CC1=CC=CC=C1)([C-](C)C)C(=C2C(=CC(=[N+]3CCOCC3)C=C2C)C)O.[Zn]

InChI

InChI=1S/C26H34NO2.2CH3.Zn/c1-6-26(19(2)3,18-22-10-8-7-9-11-22)25(28)24-20(4)16-23(17-21(24)5)27-12-14-29-15-13-27;;;/h7-11,16-17H,6,12-15,18H2,1-5H3;2*1H3;/q3*-1;/p+1