6-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienylidene]azaniumylhexanoate

Systemtic Name: 6-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienylidene]azaniumylhexanoate Openeye Name: 6-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienylidene]ammoniohexanoate CAS Name: 6-[(2E,4E)-3-methyl-5-(2,6,6-trimethyl-1-cyclohexenyl)penta-2,4-dienylidene]ammoniohexanoate IUPAC Name: 6-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienylidene]azaniumylhexanoate Traditional Name: 6-[(2E,4E)-3-methyl-5-(2,6,6-trimethylcyclohexen-1-yl)penta-2,4-dienylidene]ammoniohexanoate Formula: C21H33NO2 MolecularWeight: 331.49222

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Descriptors Computed from Structure

Canonical SMILES:

CC1=C(C(CCC1)(C)C)C=CC(=CC=[NH+]CCCCCC(=O)[O-])C

Isomeric SMILES

CC1=C(C(CCC1)(C)C)/C=C/C(=C/C=[NH+]CCCCCC(=O)[O-])/C

InChI

InChI=1S/C21H33NO2/c1-17(13-16-22-15-7-5-6-10-20(23)24)11-12-19-18(2)9-8-14-21(19,3)4/h11-13,16H,5-10,14-15H2,1-4H3,(H,23,24)/b12-11+,17-13+,22-16?