butyl-methyl-[(E,6R,7R,8R)-8-methyl-7-oxidanyl-5-oxidanylidene-dodec-10-en-6-yl]azanium

Systemtic Name: butyl-methyl-[(E,6R,7R,8R)-8-methyl-7-oxidanyl-5-oxidanylidene-dodec-10-en-6-yl]azanium Openeye Name: butyl-[(E,1R,2R,3R)-2-hydroxy-3-methyl-1-pentanoyl-hept-5-enyl]-methyl-ammonium CAS Name: butyl-[(E,6R,7R,8R)-7-hydroxy-8-methyl-5-oxododec-10-en-6-yl]-methylammonium IUPAC Name: butyl-[(E,6R,7R,8R)-7-hydroxy-8-methyl-5-oxododec-10-en-6-yl]-methylazanium Traditional Name: butyl-[(E,1R,2R,3R)-2-hydroxy-3-methyl-1-valeryl-hept-5-enyl]-methyl-ammonium Formula: C18H36NO2+ MolecularWeight: 298.48394

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Descriptors Computed from Structure

Canonical SMILES:

CCCCC(=O)C(C(C(C)CC=CC)O)[NH+](C)CCCC

Isomeric SMILES

CCCCC(=O)[C@@H]([C@@H]([C@H](C)C/C=C/C)O)[NH+](C)CCCC

InChI

InChI=1S/C18H35NO2/c1-6-9-12-15(4)18(21)17(16(20)13-10-7-2)19(5)14-11-8-3/h6,9,15,17-18,21H,7-8,10-14H2,1-5H3/p+1/b9-6+/t15-,17+,18-/m1/s1